SCD
gene geneOn this page
Also known as FADS5SCD1
Summary
SCD (stearoyl-CoA desaturase, HGNC:10571) is a protein-coding gene on chromosome 10q24.31, encoding Stearoyl-CoA desaturase (O00767). Stearoyl-CoA desaturase that utilizes O(2) and electrons from reduced cytochrome b5 to introduce the first double bond into saturated fatty acyl-CoA substrates. It is a selective cancer dependency (DepMap: 67.2% of cell lines).
This gene encodes an enzyme involved in fatty acid biosynthesis, primarily the synthesis of oleic acid. The protein belongs to the fatty acid desaturase family and is an integral membrane protein located in the endoplasmic reticulum. Transcripts of approximately 3.9 and 5.2 kb, differing only by alternative polyadenlyation signals, have been detected. A gene encoding a similar enzyme is located on chromosome 4 and a pseudogene of this gene is located on chromosome 17.
Source: NCBI Gene 6319 — RefSeq curated summary.
At a glance
- Gene–disease (curated): adrenoleukodystrophy (Limited, GenCC)
- Clinical variants (ClinVar): 33 total
- Druggable target: yes — 1 molecules with ChEMBL bioactivity
- Cancer dependency (DepMap): dependent in 67.2% of screened cell lines
- MANE Select transcript:
NM_005063
Identifiers
Gene identifiers
| Field | Value |
|---|---|
| HGNC ID | HGNC:10571 |
| Approved symbol | SCD |
| Name | stearoyl-CoA desaturase |
| Location | 10q24.31 |
| Locus type | gene with protein product |
| Status | Approved |
| Aliases | FADS5, SCD1 |
| Ensembl gene | ENSG00000099194 |
| Ensembl biotype | protein_coding |
| OMIM | 604031 |
| Entrez | 6319 |
Gene structure
Transcript identifiers
Ensembl transcripts: 6 — 6 protein_coding
ENST00000370355, ENST00000884319, ENST00000884320, ENST00000884321, ENST00000884322, ENST00000911677
RefSeq mRNA: 1 — MANE Select: NM_005063
NM_005063
CCDS: CCDS7493
Canonical transcript exons
ENST00000370355 — 6 exons
| Exon | Start | End |
|---|---|---|
| ENSE00000720696 | 100352366 | 100352496 |
| ENSE00000720697 | 100354427 | 100354632 |
| ENSE00000720699 | 100356532 | 100356764 |
| ENSE00000811324 | 100348064 | 100348346 |
| ENSE00001452458 | 100360734 | 100364826 |
| ENSE00001452460 | 100347233 | 100347531 |
Expression profiles
Bgee: expression breadth ubiquitous, 289 present calls, max score 99.89.
FANTOM5 (CAGE): breadth ubiquitous, TPM avg 245.4468 / max 21596.1616, expressed in 1780 samples.
FANTOM5 promoters (11 alternative TSS)
| Promoter ID | TPM avg | Samples expressed |
|---|---|---|
| 106524 | 120.0416 | 1231 |
| 106520 | 78.4562 | 1736 |
| 106517 | 23.8323 | 1704 |
| 106518 | 8.6489 | 1586 |
| 106519 | 5.6227 | 1407 |
| 106523 | 2.6720 | 858 |
| 106525 | 2.5774 | 755 |
| 106529 | 2.2930 | 742 |
| 106522 | 0.6569 | 367 |
| 106516 | 0.5342 | 271 |
Top tissues by expression
294 total, by Bgee expression score (0-100, higher = more expressed):
| Tissue | Anatomy ID | Expression score | Quality |
|---|---|---|---|
| inferior vagus X ganglion | UBERON:0005363 | 99.89 | gold quality |
| subthalamic nucleus | UBERON:0001906 | 99.86 | gold quality |
| superior vestibular nucleus | UBERON:0007227 | 99.85 | gold quality |
| medulla oblongata | UBERON:0001896 | 99.83 | gold quality |
| substantia nigra pars reticulata | UBERON:0001966 | 99.81 | gold quality |
| substantia nigra pars compacta | UBERON:0001965 | 99.76 | gold quality |
| lateral globus pallidus | UBERON:0002476 | 99.76 | gold quality |
| pons | UBERON:0000988 | 99.74 | gold quality |
| C1 segment of cervical spinal cord | UBERON:0006469 | 99.69 | gold quality |
| ventral tegmental area | UBERON:0002691 | 99.68 | gold quality |
| globus pallidus | UBERON:0001875 | 99.66 | gold quality |
| inferior olivary complex | UBERON:0002127 | 99.65 | gold quality |
| endothelial cell | CL:0000115 | 99.64 | gold quality |
| medial globus pallidus | UBERON:0002477 | 99.64 | gold quality |
| dorsal motor nucleus of vagus nerve | UBERON:0002870 | 99.60 | gold quality |
| midbrain | UBERON:0001891 | 99.51 | gold quality |
| substantia nigra | UBERON:0002038 | 99.48 | gold quality |
| Brodmann (1909) area 46 | UBERON:0006483 | 99.46 | gold quality |
| cranial nerve II | UBERON:0000941 | 99.45 | gold quality |
| lateral nuclear group of thalamus | UBERON:0002736 | 99.45 | gold quality |
| trigeminal ganglion | UBERON:0001675 | 99.37 | gold quality |
| spinal cord | UBERON:0002240 | 99.29 | gold quality |
| ventricular zone | UBERON:0003053 | 99.26 | gold quality |
| amygdala | UBERON:0001876 | 99.25 | gold quality |
| hypothalamus | UBERON:0001898 | 99.24 | gold quality |
| Ammon’s horn | UBERON:0001954 | 99.20 | gold quality |
| parietal lobe | UBERON:0001872 | 99.19 | gold quality |
| corpus callosum | UBERON:0002336 | 99.17 | gold quality |
| postcentral gyrus | UBERON:0002581 | 99.15 | gold quality |
| embryo | UBERON:0000922 | 99.08 | gold quality |
Single-cell (SCXA)
Detected in 13 experiment(s), a significant marker in 11.
| Experiment | Marker? | Max mean expression |
|---|---|---|
| E-MTAB-8495 | yes | 2432.11 |
| E-GEOD-86618 | yes | 757.95 |
| E-MTAB-8221 | yes | 660.91 |
| E-HCAD-1 | yes | 92.32 |
| E-HCAD-35 | yes | 73.55 |
| E-HCAD-25 | yes | 53.77 |
| E-ANND-3 | yes | 27.99 |
| E-GEOD-93593 | yes | 18.41 |
| E-GEOD-130148 | yes | 14.68 |
| E-GEOD-84465 | yes | 13.34 |
| E-GEOD-83139 | yes | 8.09 |
| E-MTAB-6075 | no | 955.57 |
| E-MTAB-9689 | no | 689.53 |
Regulation
Is transcription factor: no
miRNA regulators (miRDB)
177 targeting SCD, top 30 by miRDB confidence (max_score; target_count = how many genes the miRNA targets in total — lower means more specific):
| miRNA | Max score | Avg score | miRNA target_count |
|---|---|---|---|
| HSA-MIR-4262 | 100.00 | 73.26 | 3931 |
| HSA-MIR-200B-3P | 100.00 | 73.31 | 2693 |
| HSA-MIR-200C-3P | 100.00 | 73.35 | 2685 |
| HSA-MIR-429 | 100.00 | 73.44 | 2698 |
| HSA-MIR-12118 | 100.00 | 65.88 | 1270 |
| HSA-MIR-3613-3P | 100.00 | 76.36 | 7965 |
| HSA-MIR-6758-5P | 100.00 | 66.21 | 1470 |
| HSA-MIR-6856-5P | 100.00 | 65.47 | 1298 |
| HSA-MIR-4795-3P | 100.00 | 74.62 | 4024 |
| HSA-MIR-340-5P | 100.00 | 72.50 | 4437 |
| HSA-MIR-4283 | 100.00 | 66.42 | 2097 |
| HSA-MIR-188-3P | 100.00 | 68.76 | 1240 |
| HSA-MIR-5011-5P | 100.00 | 83.46 | 5820 |
| HSA-MIR-190A-3P | 100.00 | 80.35 | 5520 |
| HSA-MIR-3924 | 100.00 | 72.09 | 2394 |
| HSA-MIR-181A-5P | 99.99 | 72.96 | 2995 |
| HSA-MIR-181B-5P | 99.99 | 72.97 | 2996 |
| HSA-MIR-181C-5P | 99.99 | 72.95 | 2996 |
| HSA-MIR-181D-5P | 99.99 | 73.04 | 2997 |
| HSA-MIR-371B-5P | 99.99 | 75.34 | 4759 |
| HSA-MIR-4500 | 99.99 | 72.72 | 2367 |
| HSA-MIR-186-5P | 99.99 | 70.83 | 3707 |
| HSA-MIR-513B-5P | 99.99 | 69.96 | 2150 |
| HSA-MIR-4531 | 99.99 | 69.70 | 3181 |
| HSA-MIR-373-5P | 99.98 | 75.36 | 4753 |
| HSA-MIR-616-5P | 99.98 | 75.58 | 4775 |
| HSA-LET-7A-5P | 99.98 | 72.29 | 1790 |
| HSA-LET-7B-5P | 99.98 | 72.31 | 1790 |
| HSA-LET-7C-5P | 99.98 | 72.29 | 1790 |
| HSA-LET-7E-5P | 99.98 | 72.29 | 1790 |
Functional genomics
DepMap (CRISPR cell-line fitness): dependent in 67.2% of screened cell lines.
Literature-anchored findings (GeneRIF, showing 40)
- Inhibition of stearoyl-CoA desaturase activity by the cis-9,trans-11 isomer and the trans-10,cis-12 isomer of conjugated linoleic acid in human breast cancer cells. (PMID:12061775)
- stearoyl-CoA desaturase influence on plasma triglycerides in hypertriglyceridemia (PMID:12401889)
- Of genes identified in the liver whose expression is modulated by leptin, stearoyl-CoA desaturase-1 ranks at the top of the list, according to this review. (PMID:14683458)
- relationship between triglyceride levels and the ratio of plasma oleic acid to stearic acid (the 18:1/18:0 ratio), a plasma marker of SCD activity, and n-3 PUFAs in 411 Japanese, 418 Korean, and 251 Mongolian adults (PMID:14967817)
- increased palmitate and stearate desaturation by stearoyl-CoA desaturase was associated with the destabilization of ABCA1 by saturated fatty acids palmitate and stearate (PMID:14967823)
- loss of SCD expression is a frequent event in prostate adenocarcinoma (PMID:15609334)
- The identification and characterization of SCD2, and its relationship to human SCD1 and mouse SCD2, are reported. (PMID:15610069)
- No evidence that SCD sequence variation influences diabetes susceptibility or related traits. (PMID:15662557)
- Results suggest that stearoyl-CoA desaturase levels are associated with the events of neoplastic cell transformation and programmed cell death. (PMID:15708362)
- by globally regulating lipid metabolism, stearoyl-CoA desaturase activity modulates cell proliferation and survival and shows the role of endogenously synthesized monounsaturated fatty acids in sustaining the neoplastic phenotype of transformed cells (PMID:15851470)
- SCD activity index after rosiglitazone in PPARgamma mutation supports a pivotal role of PPARgamma function in SCD regulation. (PMID:15855323)
- the lipogenic gene, stearoyl-CoA desaturase 1 (SCD1), is robustly up-regulated in skeletal muscle from extremely obese humans Elevated expression of SCD1 in skeletal muscle contributes to abnormal lipid metabolism and progression of obesity. (PMID:16213227)
- SCD1 was degraded constitutively irrespective of the cellular levels of unsaturated fatty acids, which strictly regulate SCD1 gene expression. (PMID:16723740)
- study demonstrated that the gene expression of COX-2 and stearoyl-coenzyme A desaturase diminished in the chronic phase of Graves’ophthalmopathy in parallel with a decrease in clinical activity score (PMID:17614770)
- Genetic variations in the SCD1 gene are associated with body fat distribution and insulin sensitivity. (PMID:17636091)
- The results indicate that when the supply of FA to HL60 cells is limited, the intracellular content of n-3 and n-6 FA decreases and this leads to upregulation of the desaturases, D9D is doubled. (PMID:17852835)
- Results show that elevated SCD activity within adipose tissue is closely coupled to the development of insulin resistance. (PMID:18030445)
- High hepatic SCD1 activity may regulate fat accumulation in the liver and possibly protects from insulin resistance in obesity. (PMID:18286258)
- Fatty acid desaturation index (a marker of SCD1 activity) is a highly heritable trait that is associated with the dyslipidemia observed in familial combined hyperlipidemia. (PMID:18340007)
- age-related reduction in polyunsaturated fatty acid composition was inversely correlated with SCD expression and activity resulting in elevations in monounsaturated fatty acid composition (PMID:18499418)
- Changed expression of downstream PPARgamma targets after stearoyl CoA desaturase (SCD) knockdown suggests that PPARgamma up-regulation of SCD leads to increased lipogenesis and potentiation of adiponectin signaling. (PMID:18697866)
- SCD1 activity regulates Akt activation in human lung adenocarcinoma cells (PMID:18813799)
- Dyslipidemia and atherosclerosis induced by chronic intermittent hypoxia are attenuated by deficiency of stearoyl coenzyme A desaturase. (PMID:18832746)
- Data show that human fatty liver is characterized by increases in hepatic stearoyl-CoA desaturase (SCD1) and lipogenic activities. (PMID:18952834)
- decrease in lipid accumulation in apoE-transfected cells was associated with a strong downregulation of PPARs gamma1 and gamma2 and stearoyl-CoA desaturase 1 (PMID:19130493)
- associations of Delta 9 with adiposity and plasma lipids in healthy female adolescents support the concept derived from rodent models that Delta 9 activity is independently reflective of higher body mass index and higher circulatory triglyceride levels (PMID:19154947)
- SCD1 inducibility by palmitate is an individual characteristic that modulates lipid storage, palmitate-induced inflammation, endoplasmic reticulum stress, and insulin resistance. (PMID:19478146)
- data suggest that cancer cells require active SCD1 to control the rate of glucose-mediated lipogenesis, and that when SCD1 activity is impaired cells downregulate SFA synthesis via AMPK-mediated inactivation of acetyl-CoA carboxylase (PMID:19710915)
- Exogenous palmitate up-regulated de novo lipogenesis concomitantly with SCD and elongation (PMID:20032470)
- SNPs in the fatty acid desaturase gene are associated with higher blood essential fatty acids and perinatal depression. (PMID:20395685)
- potential role in disease onset and development (Review) (PMID:20565855)
- lower expression in dendritic cells compared to macrophages (PMID:20579763)
- This study demonstrates that the foreign SCD1 gene was expressed with high efficiency and induced elevated c9t11-CLA, t10c12-CLA, and n-7 fatty acid levels in mammalian cells. (PMID:20599700)
- Oleic acid, the main product of SCD1 reaction, is the predominant fatty acid of human adipose tissue triacylglycerols, associating SCD1 with the development of obesity and the metabolic syndrome. (Review) (PMID:20713121)
- We provide novel information that SCD1 activity and mRNA expression appear not to be elevated in subjects with high liver fat (PMID:21045174)
- Data suggest that the regulation of SCD1 is altered in individuals with morbid obesity and that the SCD1 protein has a different regulation in the two adipose tissues, as well as being closely linked to the degree of insulin resistance. (PMID:21060977)
- stearoyl-CoA desaturase 1 inhibition induces CHOP-dependent cell death in human cancer cells (PMID:21179554)
- stearoyl-CoA desaturase plays a key role in the regulation of androgen receptor transcriptional activity in prostate cancer cells (PMID:21331774)
- study showed cystic fibrosis cells exhibit increased metabolism along metabolic pathways leading to n-7 and n-9 fatty acids compared with wild-type cells; changes are accompanied by increased expression of Delta5, Delta6 and Delta9 desaturases and elongases 5 and 6 (PMID:21544602)
- Repression of SCD1 by alpha-linolenic acid favorably increased cholesterol efflux and decreased cholesterol accumulation in foam cells. (PMID:21658928)
Cross-species orthologs
8 orthologs
| Organism | Symbol | Gene ID |
|---|---|---|
| danio_rerio | scdb | ENSDARG00000030265 |
| danio_rerio | scd | ENSDARG00000033662 |
| mus_musculus | Scd2 | ENSMUSG00000025203 |
| mus_musculus | Scd4 | ENSMUSG00000050195 |
| rattus_norvegicus | Scd2 | ENSRNOG00000046005 |
| caenorhabditis_elegans | WBGENE00001397 | |
| caenorhabditis_elegans | WBGENE00001398 | |
| caenorhabditis_elegans | WBGENE00001399 |
Paralogs (1): SCD5 (ENSG00000145284)
Protein
Protein identifiers
Stearoyl-CoA desaturase — O00767 (reviewed: O00767)
Alternative names: Acyl-CoA desaturase, Delta(9)-desaturase, Fatty acid desaturase
All UniProt accessions (1): O00767
UniProt curated annotations — full annotation on UniProt →
Function. Stearoyl-CoA desaturase that utilizes O(2) and electrons from reduced cytochrome b5 to introduce the first double bond into saturated fatty acyl-CoA substrates. Catalyzes the insertion of a cis double bond at the delta-9 position into fatty acyl-CoA substrates including palmitoyl-CoA and stearoyl-CoA. Gives rise to a mixture of 16:1 and 18:1 unsaturated fatty acids. Plays an important role in lipid biosynthesis. Plays an important role in regulating the expression of genes that are involved in lipogenesis and in regulating mitochondrial fatty acid oxidation. Plays an important role in body energy homeostasis. Contributes to the biosynthesis of membrane phospholipids, cholesterol esters and triglycerides.
Subunit / interactions. May self-associate and form homodimers.
Subcellular location. Endoplasmic reticulum membrane.
Tissue specificity. Detected in fetal liver, lung and brain. Highly expressed in adult adipose tissue, and at lower levels in adult brain and lung.
Cofactor. Expected to bind 2 Fe(2+) ions per subunit, instead of the Zn(2+) ions seen in the 3D-structure.
Domain organisation. The histidine box domains are involved in binding the catalytic metal ions.
Similarity. Belongs to the fatty acid desaturase type 1 family.
RefSeq proteins (1): NP_005054* (*=MANE)
Domains & families (InterPro)
| ID | Name | Type |
|---|---|---|
| IPR001522 | FADS-1_CS | Conserved_site |
| IPR015876 | Acyl-CoA_DS | Family |
Enzyme classification (BRENDA):
- EC 1.14.19.1 — stearoyl-CoA 9-desaturase (BRENDA: 38 organisms, 111 substrates, 740 inhibitors, 12 Km, 4 kcat entries)
Substrate kinetics (BRENDA)
7 substrates with measured Km, best-characterized 7. Km ranges are aggregated across organisms/conditions.
| Substrate | Km (mM) | Measurements |
|---|---|---|
| STEAROYL-COA | 0.0033–0.0566 | 4 |
| NADH | 0.003–0.089 | 2 |
| NADPH | 0.038–0.8 | 2 |
| FAD | 0.001 | 1 |
| FMN | 0.0025 | 1 |
| N-HYDROXY-BENZENECARBOXIMIDAMIDE | — | 0 |
| STEAROYL-ACYL-CARRIER PROTEIN | — | 0 |
Catalyzed reactions (Rhea), 2 shown:
- octadecanoyl-CoA + 2 Fe(II)-[cytochrome b5] + O2 + 2 H(+) = (9Z)-octadecenoyl-CoA + 2 Fe(III)-[cytochrome b5] + 2 H2O (RHEA:19721)
- hexadecanoyl-CoA + 2 Fe(II)-[cytochrome b5] + O2 + 2 H(+) = (9Z)-hexadecenoyl-CoA + 2 Fe(III)-[cytochrome b5] + 2 H2O (RHEA:36931)
UniProt features (71 total): helix 21, binding site 16, sequence conflict 9, topological domain 5, strand 5, transmembrane region 4, turn 4, short sequence motif 3, modified residue 2, chain 1, sequence variant 1
Structure
Experimental structures (PDB)
1 structures.
| PDB | Method | Resolution (Å) |
|---|---|---|
| 4ZYO | X-RAY DIFFRACTION | 3.25 |
Predicted structure (AlphaFold)
| Model | pLDDT | Fraction very-high |
|---|---|---|
| AF-O00767-F1 | 90.01 | 0.85 |
Functional residue map
Curated UniProt residues grouped by drug-discovery relevance — catalytic, ligand-binding, modification, and mutation-validated positions. Source: UniProtKB sequence features.
Ligand- & substrate-binding residues (16): 75; 120; 125; 148; 155; 156; 157; 160; 161; 188; 189; 262 …
Post-translational modifications (2): 198, 203
Function
Pathways and Gene Ontology
Reactome pathways
17 pathways
| ID | Pathway |
|---|---|
| R-HSA-2426168 | Activation of gene expression by SREBF (SREBP) |
| R-HSA-75105 | Fatty acyl-CoA biosynthesis |
| R-HSA-9029558 | NR1H2 & NR1H3 regulate gene expression linked to lipogenesis |
| R-HSA-9841922 | MLL4 and MLL3 complexes regulate expression of PPARG target genes in adipogenesis and hepatic steatosis |
| R-HSA-1430728 | Metabolism |
| R-HSA-162582 | Signal Transduction |
| R-HSA-1655829 | Regulation of cholesterol biosynthesis by SREBP (SREBF) |
| R-HSA-212165 | Epigenetic regulation of gene expression |
| R-HSA-556833 | Metabolism of lipids |
| R-HSA-74160 | Gene expression (Transcription) |
| R-HSA-8957322 | Metabolism of steroids |
| R-HSA-8978868 | Fatty acid metabolism |
| R-HSA-9006931 | Signaling by Nuclear Receptors |
| R-HSA-9024446 | NR1H2 and NR1H3-mediated signaling |
| R-HSA-9818564 | Epigenetic regulation of gene expression by MLL3 and MLL4 complexes |
| R-HSA-9851695 | Epigenetic regulation of adipogenesis genes by MLL3 and MLL4 complexes |
| R-HSA-9917777 | Epigenetic regulation by WDR5-containing histone modifying complexes |
MSigDB gene sets: 450 (showing top):
FARMER_BREAST_CANCER_CLUSTER_7, RODRIGUES_THYROID_CARCINOMA_POORLY_DIFFERENTIATED_UP, MODULE_169, MODULE_255, GOMF_OXIDOREDUCTASE_ACTIVITY_ACTING_ON_PAIRED_DONORS_WITH_INCORPORATION_OR_REDUCTION_OF_MOLECULAR_OXYGEN, YAO_HOXA10_TARGETS_VIA_PROGESTERONE_UP, TTTGTAG_MIR520D, STEARMAN_LUNG_CANCER_EARLY_VS_LATE_DN, MENSE_HYPOXIA_UP, GRAESSMANN_APOPTOSIS_BY_DOXORUBICIN_DN, ACEVEDO_NORMAL_TISSUE_ADJACENT_TO_LIVER_TUMOR_DN, MODULE_317, SHAFFER_IRF4_TARGETS_IN_ACTIVATED_B_LYMPHOCYTE, IVANOVA_HEMATOPOIESIS_MATURE_CELL, HUMMERICH_BENIGN_SKIN_TUMOR_DN
GO Biological Process (7): unsaturated fatty acid biosynthetic process (GO:0006636), response to fatty acid (GO:0070542), positive regulation of cold-induced thermogenesis (GO:0120162), monounsaturated fatty acid biosynthetic process (GO:1903966), lipid metabolic process (GO:0006629), fatty acid metabolic process (GO:0006631), fatty acid biosynthetic process (GO:0006633)
GO Molecular Function (7): stearoyl-CoA 9-desaturase activity (GO:0004768), iron ion binding (GO:0005506), oxidoreductase activity (GO:0016491), palmitoyl-CoA 9-desaturase activity (GO:0032896), protein binding (GO:0005515), oxidoreductase activity, acting on paired donors, with oxidation of a pair of donors resulting in the reduction of molecular oxygen to two molecules of water (GO:0016717), metal ion binding (GO:0046872)
GO Cellular Component (4): nucleolus (GO:0005730), endoplasmic reticulum (GO:0005783), endoplasmic reticulum membrane (GO:0005789), membrane (GO:0016020)
Reactome top-level categories
Rollup of top-13 pathways:
| Category | Pathways |
|---|---|
| Metabolism of lipids | 2 |
| Regulation of cholesterol biosynthesis by SREBP (SREBF) | 1 |
| Fatty acid metabolism | 1 |
| NR1H2 and NR1H3-mediated signaling | 1 |
| Epigenetic regulation of adipogenesis genes by MLL3 and MLL4 complexes | 1 |
| Metabolism of steroids | 1 |
| Gene expression (Transcription) | 1 |
| Metabolism | 1 |
| Signal Transduction | 1 |
| Signaling by Nuclear Receptors | 1 |
| Epigenetic regulation by WDR5-containing histone modifying complexes | 1 |
| Epigenetic regulation of gene expression by MLL3 and MLL4 complexes | 1 |
| Epigenetic regulation of gene expression | 1 |
GO top-level categories
Rollup of top GO terms by namespace:
| Category | Terms |
|---|---|
| fatty acid biosynthetic process | 2 |
| acyl-CoA desaturase activity | 2 |
| unsaturated fatty acid metabolic process | 1 |
| response to lipid | 1 |
| response to oxygen-containing compound | 1 |
| positive regulation of multicellular organismal process | 1 |
| cold-induced thermogenesis | 1 |
| regulation of cold-induced thermogenesis | 1 |
| monounsaturated fatty acid metabolic process | 1 |
| primary metabolic process | 1 |
| lipid metabolic process | 1 |
| monocarboxylic acid metabolic process | 1 |
| fatty acid metabolic process | 1 |
| lipid biosynthetic process | 1 |
| monocarboxylic acid biosynthetic process | 1 |
| transition metal ion binding | 1 |
| catalytic activity | 1 |
| binding | 1 |
| oxidoreductase activity, acting on paired donors, with incorporation or reduction of molecular oxygen | 1 |
| cation binding | 1 |
| nuclear lumen | 1 |
| intracellular membraneless organelle | 1 |
| cytoplasm | 1 |
| endomembrane system | 1 |
| intracellular membrane-bounded organelle | 1 |
| organelle membrane | 1 |
| nuclear outer membrane-endoplasmic reticulum membrane network | 1 |
| endoplasmic reticulum subcompartment | 1 |
| cellular anatomical structure | 1 |
Protein interactions and networks
STRING
2780 interactions, top by confidence (×1000):
| Protein A | Protein B | Partner UniProt | Score |
|---|---|---|---|
| SCD | CYB5B | O43169 | 984 |
| SCD | CYB5A | P00167 | 979 |
| SCD | FADS2 | O95864 | 963 |
| SCD | FADS1 | O60427 | 948 |
| SCD | FADS3 | Q9Y5Q0 | 902 |
| SCD | ACACA | Q13085 | 893 |
| SCD | SREBF1 | P36956 | 892 |
| SCD | FASN | P49327 | 890 |
| SCD | CYB5R4 | Q7L1T6 | 868 |
| SCD | DGAT2 | Q96PD7 | 839 |
| SCD | GPAM | Q9HCL2 | 828 |
| SCD | CYB5RL | Q6IPT4 | 822 |
| SCD | ELOVL6 | Q9H5J4 | 820 |
| SCD | CYB5R1 | Q9UHQ9 | 818 |
| SCD | CYB5R2 | Q6BCY4 | 818 |
IntAct
181 interactions, top by confidence:
| A | B | Type | Score |
|---|---|---|---|
| IFT70B | IFT56 | psi-mi:“MI:0914”(association) | 0.790 |
| ESYT1 | ESYT2 | psi-mi:“MI:0914”(association) | 0.770 |
| CFTR | ESYT2 | psi-mi:“MI:2364”(proximity) | 0.710 |
| SCD | TMPRSS2 | psi-mi:“MI:0915”(physical association) | 0.600 |
| SCD | TIMMDC1 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | HSD17B13 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | SCN3B | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | TMX2 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | RETREG3 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | RNF5 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | SPAG4 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | CLEC12B | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | CD207 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | REEP2 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | CERS4 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | SLC10A6 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | GPX8 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | CYB561 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | SEC11C | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | STOM | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | TLCD4 | psi-mi:“MI:0915”(physical association) | 0.560 |
| SCD | PVR | psi-mi:“MI:0915”(physical association) | 0.560 |
BioGRID (215): SCD (Affinity Capture-MS), HSD17B12 (Co-fractionation), NSUN5 (Co-fractionation), RPL14 (Co-fractionation), SCD (Co-fractionation), SCD (Co-fractionation), SCD (Co-fractionation), SCD (Co-fractionation), SSR4 (Co-fractionation), VAPB (Co-fractionation), VCP (Co-fractionation), SCD (Proximity Label-MS), SCD (Proximity Label-MS), SCD (Reconstituted Complex), SCD (Affinity Capture-MS)
ESM2 similar proteins: A0A0C5Q309, A3F5L2, A9SIZ6, B7SB91, B7SB92, C4R613, G5ED44, G5EG11, G5EGH6, G5EGN2, O00767, O02858, O04353, O44186, O44390, O59715, O62849, O74212, O94523, P07308, P13011, P13516, P48618, P48623, P48624, Q0VAX3, Q2KIA4, Q3EBF7, Q43469, Q594P3, Q59J82, Q64420, Q6P7B9, Q6RS96, Q6T707, Q6US81, Q704F0, Q75PL7, Q79EF1, Q86SK9
Diamond homologs: A0A0C5Q309, B7SB91, B7SB92, G5ED44, G5EGH6, G5EGN2, O00767, O02858, O44390, O62849, O94523, P07308, P0DOW2, P0DOW3, P13011, P13516, P21147, Q12618, Q2KIA4, Q64420, Q6P7B9, Q6T707, Q6US81, Q704E9, Q75PL7, Q79F73, Q86SK9, Q8ISS3, Q92038, Q95MI7, Q99PL7, Q9BH41, Q9FPD5, Q9LMI4, Q9LVZ3, Q9TT94, Q55406, Q949X0, Q9LMI3, Q9LND8
SIGNOR signaling
2 interactions.
| A | Effect | B | Mechanism |
|---|---|---|---|
| PRKAA1 | “down-regulates quantity by repression” | SCD | “transcriptional regulation” |
| MK-8245 | down-regulates | SCD | “chemical inhibition” |
Enriched among interaction partners
Reactome pathways and GO biological processes over-represented among this gene’s 112 IntAct physical interaction partners (hypergeometric vs the genome-wide background, BH-FDR, gene-set size 15–500, ranked by fold). A functional readout of the neighbourhood — distinct from this gene’s own memberships above, and biased toward well-studied / hub proteins, so read it as themes rather than proof.
Reactome pathways:
| Pathway | Partners | Fold | FDR |
|---|---|---|---|
| PD-L1(CD274) glycosylation and translocation to plasma membrane | 5 | 35.5× | 4e-05 |
| Regulation of CDH1 posttranslational processing and trafficking to plasma membrane | 5 | 23.0× | 2e-04 |
| Maturation of spike protein | 5 | 18.2× | 5e-04 |
| Maturation of DENV proteins | 6 | 17.4× | 1e-04 |
| Regulation of RAS by GAPs | 5 | 13.3× | 1e-03 |
| Asparagine N-linked glycosylation | 7 | 5.8× | 2e-03 |
| Neutrophil degranulation | 10 | 3.2× | 8e-03 |
GO biological processes:
| GO term | Partners | Fold | FDR |
|---|---|---|---|
| protein N-linked glycosylation | 5 | 13.4× | 8e-03 |
Disease & clinical
Clinical variants and AI predictions
ClinVar
33 variants total. Per-class counts are floors (≥ shown; pagination cap):
| Classification | Count (floor) |
|---|---|
| Pathogenic | 0 |
| Likely pathogenic | 0 |
| Uncertain significance | 20 |
| Likely benign | 2 |
| Benign | 3 |
Top pathogenic / likely-pathogenic (0)
SpliceAI
993 predictions. Top by Δscore:
| Variant | Effect | Δscore |
|---|---|---|
| 10:100347526:G:GT | donor_gain | 1.0000 |
| 10:100347529:GAT:G | donor_gain | 1.0000 |
| 10:100347532:G:GG | donor_gain | 1.0000 |
| 10:100348223:G:GT | donor_gain | 1.0000 |
| 10:100352364:AGG:A | acceptor_gain | 1.0000 |
| 10:100352365:GGG:G | acceptor_gain | 1.0000 |
| 10:100354422:CCCA:C | acceptor_loss | 1.0000 |
| 10:100354423:CCA:C | acceptor_loss | 1.0000 |
| 10:100354424:CA:C | acceptor_loss | 1.0000 |
| 10:100354425:A:AG | acceptor_gain | 1.0000 |
| 10:100354425:AGAAT:A | acceptor_gain | 1.0000 |
| 10:100354426:G:GC | acceptor_gain | 1.0000 |
| 10:100354426:GA:G | acceptor_gain | 1.0000 |
| 10:100354426:GAA:G | acceptor_gain | 1.0000 |
| 10:100354426:GAAT:G | acceptor_gain | 1.0000 |
| 10:100354426:GAATG:G | acceptor_gain | 1.0000 |
| 10:100354575:G:T | donor_gain | 1.0000 |
| 10:100354629:GGAG:G | donor_gain | 1.0000 |
| 10:100354630:G:GT | donor_gain | 1.0000 |
| 10:100354630:GAG:G | donor_gain | 1.0000 |
| 10:100354632:GGTG:G | donor_loss | 1.0000 |
| 10:100354633:G:GG | donor_gain | 1.0000 |
| 10:100354634:T:G | donor_loss | 1.0000 |
| 10:100360926:GTGGC:G | donor_gain | 1.0000 |
| 10:100360927:TGGCT:T | donor_gain | 1.0000 |
| 10:100360928:GGC:G | donor_gain | 1.0000 |
| 10:100360928:GGCTG:G | donor_gain | 1.0000 |
| 10:100360929:GC:G | donor_gain | 1.0000 |
| 10:100360930:C:G | donor_gain | 1.0000 |
| 10:100347477:A:T | donor_gain | 0.9900 |
AlphaMissense
2363 scored. Top likely-pathogenic:
| Variant | Protein change | am_pathogenicity |
|---|---|---|
| 10:100354442:T:A | W153R | 0.999 |
| 10:100354442:T:C | W153R | 0.999 |
| 10:100354444:G:C | W153C | 0.999 |
| 10:100354444:G:T | W153C | 0.999 |
| 10:100354454:C:G | H157D | 0.999 |
| 10:100354458:G:C | R158P | 0.999 |
| 10:100354466:C:G | H161D | 0.999 |
| 10:100354535:T:A | W184R | 0.999 |
| 10:100354535:T:C | W184R | 0.999 |
| 10:100356679:C:A | N265K | 0.999 |
| 10:100356679:C:G | N265K | 0.999 |
| 10:100352413:C:G | H120D | 0.998 |
| 10:100352422:T:A | W123R | 0.998 |
| 10:100352422:T:C | W123R | 0.998 |
| 10:100352428:C:G | H125D | 0.998 |
| 10:100354449:G:C | R155P | 0.998 |
| 10:100354456:C:A | H157Q | 0.998 |
| 10:100354456:C:G | H157Q | 0.998 |
| 10:100354457:C:A | R158S | 0.998 |
| 10:100354463:C:G | H160D | 0.998 |
| 10:100354496:C:G | H171D | 0.998 |
| 10:100354520:T:C | F179L | 0.998 |
| 10:100354522:C:A | F179L | 0.998 |
| 10:100354522:C:G | F179L | 0.998 |
| 10:100360745:C:G | H298D | 0.998 |
| 10:100360750:C:A | N299K | 0.998 |
| 10:100360750:C:G | N299K | 0.998 |
| 10:100352416:C:A | R121S | 0.997 |
| 10:100352425:A:C | S124R | 0.997 |
| 10:100352427:C:A | S124R | 0.997 |
dbSNP variants (sampled 300 via entrez): RS1000077946 (10:100358254 G>A), RS1000139666 (10:100358470 T>C), RS1000503829 (10:100346017 G>C), RS1000527886 (10:100345854 T>C,G), RS1000624603 (10:100359787 G>A), RS1000653929 (10:100350884 T>C), RS1000726671 (10:100350664 C>G,T), RS1000748531 (10:100346027 G>T), RS1001041543 (10:100352965 G>A), RS1001198692 (10:100359440 C>G), RS1001357616 (10:100351808 T>A), RS1001470244 (10:100351595 C>G,T), RS1001931503 (10:100349197 G>T), RS1002364518 (10:100346437 T>A,C), RS1002404261 (10:100348908 G>A,T)
Disease associations
OMIM: gene MIM:604031 | disease phenotypes:
GenCC curated gene-disease
| Disease | Classification | Inheritance |
|---|---|---|
| adrenoleukodystrophy | Limited | Autosomal recessive |
Mondo (1): adrenoleukodystrophy (MONDO:0018544)
Orphanet (0):
HPO phenotypes
0 total (0 of 0 shown, HPO-id order):
GWAS associations
0 associations (top):
MeSH disease descriptors (1)
| Descriptor | Name | Tree numbers |
|---|---|---|
| D000326 | Adrenoleukodystrophy | C10.228.140.163.100.084; C10.228.140.163.100.362.250; C10.228.140.695.625.250; C10.314.400.250; C10.597.606.360.455.124; C16.320.322.500.124; C16.320.400.525.124; C16.320.565.189.084; C16.320.565.189.362.250; C16.320.565.663.100; C18.452.132.100.084; C18.452.132.100.362.250; C18.452.648.189.084; C18.452.648.189.362.250; C18.452.648.663.100; C19.053.500.270 |
Drugs & pharmacology
Drug and pharmacology data
Is drug target: yes
ChEMBL targets (1): CHEMBL5555 (SINGLE PROTEIN)
Molecules with ChEMBL bioactivity
1 molecules (phase ≥1), by development phase (incl. off-target/promiscuous compounds). Patent mentions across the top 20 by phase: 169 (via chembl_molecule»patent_compound — counts attach to the compound, not the gene–compound relationship, so off-target/promiscuous molecules can dominate).
| Molecule | Name | Phase | Patents |
|---|---|---|---|
| CHEMBL1938870 | MK-8245 | 1 | 169 |
PharmGKB: 1 entry (VIP=true, CPIC=false)
Binding affinities (BindingDB)
148 measured of 182 human assays (182 total across all organisms); most potent 50 below. Values come from heterogeneous assays and are not directly comparable.
| Ligand | Measure | Value | Patent |
|---|---|---|---|
| 2-[5-[3-[5-(trifluoromethoxy)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[5-[5-(trifluoromethoxy)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]-1,3,4-thiadiazol-2-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-[5-(trifluoromethoxy)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[3-(5-bromospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-(5-bromospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-(5-methylspiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[5-[5-(trifluoromethyl)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]-1,3,4-thiadiazol-2-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-[5-(trifluoromethyl)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 1 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[3-[2-(5-chlorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]-2-oxoimidazol-1-yl]acetic acid | IC50 | 3 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 4-(2-chloro-5-fluorophenoxy)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 10 nM | US-12268687: Compounds and uses thereof |
| 2-[5-[3-(5-chlorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 11 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[5-(5-chlorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3,4-thiadiazol-2-yl]tetrazol-2-yl]acetic acid | IC50 | 12 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-(5-chloro-4-oxospiro[3H-chromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 12 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[2-(5-chlorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 13 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[5-(5-methoxyspiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-1,3,4-thiadiazol-2-yl]tetrazol-2-yl]acetic acid | IC50 | 13 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[3-(5-chloro-4-oxospiro[3H-chromene-2,4’-piperidine]-1’-yl)-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 17 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 5-chloro-3-[4-(2-chloro-5-fluorophenoxy)piperidin-1-yl]-1-methylpyrazin-2-one | IC50 | 20 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)-4-(3-(trifluoromethyl)phenoxy)piperidine-1-carboxamide | IC50 | 20 nM | US-12268687: Compounds and uses thereof |
| 2-[5-[2-(8-chloro-1-oxospiro[4H-isochromene-3,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 21 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-[5-(5-chloro-4-oxospiro[3H-chromene-2,4’-piperidine]-1’-yl)-1,3,4-thiadiazol-2-yl]tetrazol-2-yl]acetic acid | IC50 | 24 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 3-[4-(2-chloro-5-fluorophenoxy)piperidin-1-yl]-1,2,4-triazine | IC50 | 30 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 1-(1,2,4-triazin-3-yl)-N-[2-(trifluoromethyl)phenyl]piperidin-4-amine | IC50 | 30 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 4-(3,5-difluorophenoxy)-N-(1,5-dimethyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide | IC50 | 40 nM | US-12268687: Compounds and uses thereof |
| 2-[5-[2-(4-oxospiro[3H-chromene-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 41 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 2-[5-(2-spiro[1,2-dihydroindene-3,4’-piperidine]-1’-yl-1,3-thiazol-5-yl)tetrazol-2-yl]acetic acid | IC50 | 49 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 4-(2-chloro-5-fluorophenoxy)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 50 nM | US-12268687: Compounds and uses thereof |
| 4-[(3,5-difluorophenyl)methyl]-N-(1,5-dimethyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide | IC50 | 50 nM | US-12268687: Compounds and uses thereof |
| 4-(2-chloro-3,5-difluorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 50 nM | US-12268687: Compounds and uses thereof |
| 3-[4-(2-bromo-4,5-difluorophenoxy)piperidin-1-yl]-1,2,4-triazine | IC50 | 55 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 4-(2,3-dichlorophenoxy)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 60 nM | US-12268687: Compounds and uses thereof |
| 2-[5-[2-(5-chloro-4-oxospiro[3H-1,3-benzoxazine-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 62 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 3-[4-(2-chloro-5-nitrophenoxy)piperidin-1-yl]-1,2,4-triazine | IC50 | 65 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 2-[5-(2-spiro[2H-1-benzofuran-3,4’-piperidine]-1’-yl-1,3-thiazol-5-yl)tetrazol-2-yl]acetic acid | IC50 | 65 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 4-(3-fluoro-4-(trifluoromethyl)phenoxy)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 70 nM | US-12268687: Compounds and uses thereof |
| 4-[4-fluoro-2-(trifluoromethyl)phenoxy]-N-(1-methyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide | IC50 | 80 nM | US-12268687: Compounds and uses thereof |
| 4-(2-chloro-4,5-difluorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 80 nM | US-12268687: Compounds and uses thereof |
| 1-methyl-3-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]pyrazin-2-one | IC50 | 100 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 3-[4-[2-chloro-5-(trifluoromethyl)phenoxy]piperidin-1-yl]-1,2,4-triazine | IC50 | 100 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 3-[4-(2-chloro-5-fluorophenoxy)piperidin-1-yl]-5-methyl-1,2,4-triazine | IC50 | 100 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 3-[4-(2-chloro-5-fluorophenoxy)piperidin-1-yl]-6-methyl-1,2,4-triazine | IC50 | 100 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 4-(3-chloro-4,5-difluorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 130 nM | US-12268687: Compounds and uses thereof |
| 4-(3-chloro-5-fluorobenzyl)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 160 nM | US-12268687: Compounds and uses thereof |
| 4-(2-Chloro-3-fluorophenoxy)-N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)piperidine-1-carboxamide | IC50 | 170 nM | US-12268687: Compounds and uses thereof |
| 6-(5-(4-(3,5-difluorobenzyl)piperidin-1-yl)-1,3,4-thiadiazol-2-yl)-2-methylpyridazin-3(2H)-one | IC50 | 180 nM | US-12268687: Compounds and uses thereof |
| 2-[5-[2-(4-oxospiro[3H-1,3-benzoxazine-2,4’-piperidine]-1’-yl)-1,3-thiazol-5-yl]tetrazol-2-yl]acetic acid | IC50 | 181 nM | US-9168248: Spiro compounds useful as inhibitors of stearoyl-coenzyme A delta-9 desaturase |
| 5-chloro-1-methyl-3-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]pyrazin-2-one | IC50 | 200 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 5-chloro-3-[4-[2-chloro-5-(trifluoromethyl)phenoxy]piperidin-1-yl]-1-methylpyrazin-2-one | IC50 | 200 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 4-[4-[2-chloro-5-(trifluoromethyl)phenoxy]piperidin-1-yl]-2-methylpyridazin-3-one | IC50 | 200 nM | US-8962837: Nitrogen heterocycle derivatives, preparation thereof and application thereof in human therapeutics |
| 4-(3,4-difluorophenoxy)-N-(1,5-dimethyl-6-oxopyridazin-3-yl)piperidine-1-carboxamide | IC50 | 200 nM | US-12268687: Compounds and uses thereof |
| N-(1-methyl-6-oxo-1,6-dihydropyridazin-3-yl)-4-(2-(trifluoromethyl)phenoxy)piperidine-1-carboxamide | IC50 | 220 nM | US-12268687: Compounds and uses thereof |
ChEMBL bioactivities
838 potent at pChembl≥5 of 911 total, top 50 by pChembl (potency: 10 = 0.1 nM, 6 = 1 µM).
| pChembl | Type | Value | Unit | Molecule |
|---|---|---|---|---|
| 10.52 | IC50 | 0.03 | nM | CHEMBL593108 |
| 10.40 | IC50 | 0.04 | nM | CHEMBL564507 |
| 10.30 | IC50 | 0.05 | nM | CHEMBL494748 |
| 10.22 | IC50 | 0.06 | nM | CHEMBL593108 |
| 10.22 | IC50 | 0.06 | nM | CHEMBL1276595 |
| 10.17 | IC50 | 0.068 | nM | CHEMBL594289 |
| 10.00 | IC50 | 0.1 | nM | CHEMBL1276623 |
| 9.70 | IC50 | 0.2 | nM | CHEMBL552173 |
| 9.70 | IC50 | 0.2 | nM | CHEMBL1276653 |
| 9.52 | IC50 | 0.3 | nM | CHEMBL552173 |
| 9.52 | IC50 | 0.3 | nM | CHEMBL1276654 |
| 9.35 | IC50 | 0.45 | nM | CHEMBL605412 |
| 9.32 | IC50 | 0.48 | nM | CHEMBL595247 |
| 9.30 | IC50 | 0.5 | nM | CHEMBL3127535 |
| 9.30 | IC50 | 0.5 | nM | CHEMBL572876 |
| 9.25 | IC50 | 0.56 | nM | CHEMBL594084 |
| 9.22 | IC50 | 0.6 | nM | CHEMBL549625 |
| 9.22 | IC50 | 0.6 | nM | CHEMBL557445 |
| 9.16 | IC50 | 0.69 | nM | CHEMBL607314 |
| 9.15 | IC50 | 0.7 | nM | CHEMBL1276653 |
| 9.15 | IC50 | 0.7 | nM | CHEMBL1276654 |
| 9.10 | IC50 | 0.8 | nM | CHEMBL593108 |
| 9.00 | IC50 | 1 | nM | MK-8245 |
| 9.00 | IC50 | 1 | nM | CHEMBL3970644 |
| 9.00 | IC50 | 1 | nM | CHEMBL3895997 |
| 9.00 | IC50 | 1 | nM | CHEMBL3914019 |
| 9.00 | IC50 | 1 | nM | CHEMBL3942017 |
| 9.00 | IC50 | 1 | nM | CHEMBL3919514 |
| 9.00 | IC50 | 1 | nM | CHEMBL3979824 |
| 9.00 | IC50 | 1 | nM | CHEMBL3976984 |
| 9.00 | IC50 | 1 | nM | CHEMBL3914136 |
| 9.00 | IC50 | 1 | nM | CHEMBL552126 |
| 9.00 | IC50 | 1 | nM | CHEMBL550800 |
| 9.00 | IC50 | 1 | nM | CHEMBL595254 |
| 9.00 | IC50 | 1 | nM | CHEMBL595255 |
| 9.00 | IC50 | 1 | nM | CHEMBL594071 |
| 9.00 | IC50 | 1 | nM | CHEMBL1087015 |
| 9.00 | IC50 | 1 | nM | CHEMBL1276685 |
| 9.00 | IC50 | 1 | nM | CHEMBL1276595 |
| 9.00 | IC50 | 1 | nM | CHEMBL1276623 |
| 8.92 | IC50 | 1.2 | nM | CHEMBL4066506 |
| 8.70 | IC50 | 2 | nM | CHEMBL3127534 |
| 8.70 | IC50 | 2 | nM | CHEMBL3127654 |
| 8.70 | IC50 | 2 | nM | CHEMBL549758 |
| 8.70 | IC50 | 2 | nM | CHEMBL552270 |
| 8.70 | IC50 | 2 | nM | CHEMBL594995 |
| 8.70 | IC50 | 2 | nM | CHEMBL595254 |
| 8.64 | IC50 | 2.3 | nM | CHEMBL4104190 |
| 8.60 | IC50 | 2.5 | nM | CHEMBL4094042 |
| 8.57 | IC50 | 2.7 | nM | CHEMBL575817 |
PubChem BioAssay actives
604 with measured affinity, of 861 total; 50 most potent distinct compounds. Largely complementary to BindingDB; screening values are coarse (µM, 4 dp), so sub-nM hits tie at the floor.
| Compound | Assay | Type | Value | Unit |
|---|---|---|---|---|
| 1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]-5-(trifluoromethyl)spiro[3,4-dihydrochromene-2,4’-piperidine] | 535944: Inhibition of human SCD1 | ic50 | <0.0001 | uM |
| 4-(ethylamino)-3-(2-hydroxyethoxy)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]benzamide | 426050: Inhibition of stearoyl-CoA desaturase 1 in human microsome assessed as conversion of [14C]stearate to [14C]oleate | ic50 | <0.0001 | uM |
| 5-chloro-1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]spiro[3,4-dihydrochromene-2,4’-piperidine] | 535945: Inhibition of SCD1 in HEK293A cell microsomes assessed as reduction in conversion of [14C]stearic acid to [14C]oleic acid after 30 mins | ic50 | 0.0001 | uM |
| N-[2-[7-[[4-chloro-3-(trifluoromethyl)phenyl]methylamino]-3-(4-methoxyphenyl)-2-oxoquinoxalin-1-yl]ethyl]acetamide | 1859284: Inhibition of SCD in human HepG2 cells | ic50 | 0.0001 | uM |
| N-(2-hydroxy-2-phenylethyl)-6-spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-ylpyridazine-3-carboxamide | 455002: Inhibition of human SCD1 expressed in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0001 | uM |
| 5,8-difluoro-1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]spiro[3,4-dihydrochromene-2,4’-piperidine] | 535945: Inhibition of SCD1 in HEK293A cell microsomes assessed as reduction in conversion of [14C]stearic acid to [14C]oleic acid after 30 mins | ic50 | 0.0001 | uM |
| N-[5-[[3,5-bis(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0002 | uM |
| 5-methyl-1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]spiro[3,4-dihydrochromene-2,4’-piperidine] | 535945: Inhibition of SCD1 in HEK293A cell microsomes assessed as reduction in conversion of [14C]stearic acid to [14C]oleic acid after 30 mins | ic50 | 0.0002 | uM |
| 5-fluoro-1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]spiro[3,4-dihydrochromene-2,4’-piperidine] | 535945: Inhibition of SCD1 in HEK293A cell microsomes assessed as reduction in conversion of [14C]stearic acid to [14C]oleic acid after 30 mins | ic50 | 0.0003 | uM |
| N-(2-hydroxy-2-pyridin-3-ylethyl)-6-[5-(trifluoromethyl)spiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl]pyridazine-3-carboxamide | 455000: Inhibition of SCD1 in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate after 60 mins in presence of S9 microsomal fraction | ic50 | 0.0004 | uM |
| N-[2-[6-[(3,4-dichlorophenyl)methylamino]-3-oxo-1,4-benzoxazin-4-yl]ethyl]-2-hydroxyacetamide | 436928: Inhibition of stearoyl-CoA delta9 desaturase in human HepG2 cells | ic50 | 0.0005 | uM |
| N-(2-hydroxy-2-phenylethyl)-6-(4-hydroxyspiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)pyridazine-3-carboxamide | 455002: Inhibition of human SCD1 expressed in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0005 | uM |
| [5-[6-[4-(6-fluoro-2,3-dihydroindol-1-yl)piperidin-1-yl]pyridazin-3-yl]-2-pyridinyl]methanol | 1074265: Inhibition of SCD1 in human A431 cells assessed as [13C]-palmitic acid conversion to [13C]-palmitoleic acid after 4 hrs by LC/MS analysis | ic50 | 0.0005 | uM |
| 3-(2-hydroxyethoxy)-4-(2-methoxyethoxy)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]benzamide | 426050: Inhibition of stearoyl-CoA desaturase 1 in human microsome assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0006 | uM |
| N-[5-[[4-fluoro-3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0006 | uM |
| N-(2-hydroxy-2-phenylethyl)-6-(3-hydroxyspiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)pyridazine-3-carboxamide | 455002: Inhibition of human SCD1 expressed in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0006 | uM |
| N-(2-hydroxy-2-phenylethyl)-6-(4-oxospiro[3H-chromene-2,4’-piperidine]-1’-yl)pyridazine-3-carboxamide | 455002: Inhibition of human SCD1 expressed in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0007 | uM |
| [3-[2-[4-[2-(trifluoromethyl)phenoxy]piperidin-1-yl]-1,3-thiazol-5-yl]-1,2,4-oxadiazol-5-yl]methanol | 464562: Inhibition of SCD1 in human HepG2 cells assessed as [14C]stearic acid to [14C]oleic acid conversion pretreated 15 mins before [14C]stearic acid addition measured after 4 hrs by HPLC based scintillation assay | ic50 | 0.0010 | uM |
| 2-[5-[3-[4-(2-bromo-5-fluorophenoxy)piperidin-1-yl]-1,2-oxazol-5-yl]tetrazol-2-yl]acetic acid | 692201: Inhibition of human SCD-1 | ic50 | 0.0010 | uM |
| 1’-[6-[5-(pyridin-3-ylmethyl)-1,3,4-oxadiazol-2-yl]pyridazin-3-yl]spiro[3,4-dihydrochromene-2,4’-piperidine] | 535945: Inhibition of SCD1 in HEK293A cell microsomes assessed as reduction in conversion of [14C]stearic acid to [14C]oleic acid after 30 mins | ic50 | 0.0010 | uM |
| 6-(5-chlorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-N-(2-hydroxy-2-pyridin-3-ylethyl)pyridazine-3-carboxamide | 455000: Inhibition of SCD1 in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate after 60 mins in presence of S9 microsomal fraction | ic50 | 0.0010 | uM |
| N-[5-[(3,4-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0010 | uM |
| N-[5-[(3,5-dichlorophenyl)methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0010 | uM |
| N-(2-hydroxy-2-pyridin-3-ylethyl)-6-(5-methylspiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)pyridazine-3-carboxamide | 455000: Inhibition of SCD1 in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate after 60 mins in presence of S9 microsomal fraction | ic50 | 0.0010 | uM |
| 1’-[6-[5-(pyridin-3-ylmethyl)-1H-1,2,4-triazol-3-yl]pyridazin-3-yl]-5-(trifluoromethyl)spiro[3,4-dihydrochromene-2,4’-piperidine] | 455000: Inhibition of SCD1 in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate after 60 mins in presence of S9 microsomal fraction | ic50 | 0.0010 | uM |
| [5-[6-[4-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]piperidin-1-yl]pyridazin-3-yl]-1,2,4-thiadiazol-3-yl]methanol | 1485983: Displacement of (5-(6-(10H-spiro(1-benzofuran-3,30-pyrrolidin)-10-yl)pyridazin-3-yl)-1,2,4-oxadiazol-3-yl)[3H2]methanol from SCD1 in human liver microsomes after 120 mins TopCount liquid scintillation counting method | ic50 | 0.0012 | uM |
| N-[5-[(3-chloro-4-fluorophenyl)methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0020 | uM |
| 4-ethoxy-3-(2-hydroxyethoxy)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]benzamide | 426050: Inhibition of stearoyl-CoA desaturase 1 in human microsome assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0020 | uM |
| 6-(5,8-difluorospiro[3,4-dihydrochromene-2,4’-piperidine]-1’-yl)-N-(2-hydroxy-2-pyridin-3-ylethyl)pyridazine-3-carboxamide | 455000: Inhibition of SCD1 in human 293A cells assessed as conversion of [14C]stearate to [14C]oleate after 60 mins in presence of S9 microsomal fraction | ic50 | 0.0020 | uM |
| 6-fluoro-1-[1-[6-(6-methyl-3-pyridinyl)pyridazin-3-yl]piperidin-4-yl]-2,3-dihydroindole | 1074265: Inhibition of SCD1 in human A431 cells assessed as [13C]-palmitic acid conversion to [13C]-palmitoleic acid after 4 hrs by LC/MS analysis | ic50 | 0.0020 | uM |
| 2-[6-[4-(6-fluoro-2,3-dihydroindol-1-yl)piperidin-1-yl]pyridazin-3-yl]-4-methyl-1,3-thiazole | 1074265: Inhibition of SCD1 in human A431 cells assessed as [13C]-palmitic acid conversion to [13C]-palmitoleic acid after 4 hrs by LC/MS analysis | ic50 | 0.0020 | uM |
| [5-[6-[4-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]piperidin-1-yl]pyridazin-3-yl]-1,2,4-oxadiazol-3-yl]methanol | 1485983: Displacement of (5-(6-(10H-spiro(1-benzofuran-3,30-pyrrolidin)-10-yl)pyridazin-3-yl)-1,2,4-oxadiazol-3-yl)[3H2]methanol from SCD1 in human liver microsomes after 120 mins TopCount liquid scintillation counting method | ic50 | 0.0023 | uM |
| [5-[6-[4-(trifluoromethyl)-4-[4-(trifluoromethyl)phenyl]piperidin-1-yl]pyridazin-3-yl]-1,3,4-thiadiazol-2-yl]methanol | 1485983: Displacement of (5-(6-(10H-spiro(1-benzofuran-3,30-pyrrolidin)-10-yl)pyridazin-3-yl)-1,2,4-oxadiazol-3-yl)[3H2]methanol from SCD1 in human liver microsomes after 120 mins TopCount liquid scintillation counting method | ic50 | 0.0025 | uM |
| 2-hydroxy-N-[2-[2-oxo-3-(trifluoromethyl)-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]acetamide | 436928: Inhibition of stearoyl-CoA delta9 desaturase in human HepG2 cells | ic50 | 0.0027 | uM |
| N-[5-(hydroxymethyl)-1,3-thiazol-2-yl]-4-[[2-(trifluoromethyl)anilino]methyl]benzamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0028 | uM |
| 3-[2-(4-methoxyphenyl)-3-oxo-6-[[3-(trifluoromethyl)phenyl]methylamino]pyrido[2,3-b]pyrazin-4-yl]propanamide | 414423: Inhibition of Delta-9-desaturase in human HepG2 cells | ic50 | 0.0028 | uM |
| N-[5-[(3,5-difluorophenyl)methyl]-1,3-thiazol-2-yl]-3-(2-hydroxyethoxy)-4-methoxybenzamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0029 | uM |
| (E)-3-(4-methoxyphenyl)-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]prop-2-enamide | 430729: Inhibition of SCD1 in human microsomes assessed as conversion of [14C]stearate to [14C]oleate after 60 mins | ic50 | 0.0030 | uM |
| 4-[(2-butylanilino)methyl]-N-[4-(2-hydroxyethyl)-1,3-thiazol-2-yl]benzamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0030 | uM |
| 2-[2-[[4-[(2-hexylanilino)methyl]benzoyl]amino]-1,3-thiazol-4-yl]acetic acid | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0030 | uM |
| N-(4-chlorophenyl)-6-[4-[2-(trifluoromethyl)benzoyl]piperazin-1-yl]pyridazine-3-carboxamide | 721942: Inhibition of SCD1 in human HepG2 cells using [14C]-stearate substrate assessed as decreased production of [14C]-oleic acid after 24 hrs | ic50 | 0.0030 | uM |
| 3-(2-hydroxyethoxy)-4-methoxy-N-[5-[[3-(trifluoromethyl)phenyl]methyl]-1,3-thiazol-2-yl]benzamide | 426050: Inhibition of stearoyl-CoA desaturase 1 in human microsome assessed as conversion of [14C]stearate to [14C]oleate | ic50 | 0.0030 | uM |
| [1-[6-[4-(6-fluoro-2,3-dihydroindol-1-yl)piperidin-1-yl]pyridazin-3-yl]imidazol-4-yl]methanol | 1074265: Inhibition of SCD1 in human A431 cells assessed as [13C]-palmitic acid conversion to [13C]-palmitoleic acid after 4 hrs by LC/MS analysis | ic50 | 0.0030 | uM |
| N-[2-[7-[(4-fluoro-3-methylphenyl)methylamino]-3-(4-methoxyphenyl)-2-oxoquinoxalin-1-yl]ethyl]acetamide | 414423: Inhibition of Delta-9-desaturase in human HepG2 cells | ic50 | 0.0031 | uM |
| N-[2-[3-(4-ethylphenyl)-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]acetamide | 414423: Inhibition of Delta-9-desaturase in human HepG2 cells | ic50 | 0.0032 | uM |
| 4-[(2-butylanilino)methyl]-N-[4-(hydroxymethyl)-1,3-thiazol-2-yl]benzamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0032 | uM |
| N-[2-[3-(4-methoxyphenyl)-2-oxo-7-[[3-(trifluoromethyl)phenyl]methylamino]quinoxalin-1-yl]ethyl]acetamide | 414423: Inhibition of Delta-9-desaturase in human HepG2 cells | ic50 | 0.0033 | uM |
| N-[4-(hydroxymethyl)-1,3-thiazol-2-yl]-4-[[2-(trifluoromethyl)anilino]methyl]benzamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0038 | uM |
| N-[5-(2-hydroxyethyl)-1,3-thiazol-2-yl]-4-[[2-(trifluoromethyl)anilino]methyl]benzamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0038 | uM |
| N-[4-(2-hydroxyethyl)-1,3-thiazol-2-yl]-5-[[2-(trifluoromethyl)anilino]methyl]thiophene-2-carboxamide | 1421978: Inhibition of recombinant human SCD1 expressed in baculovirus expression system assessed as reduction in [3H]H2O production using stearoyl [9,10-3H]CoA as substrate in presence of NADH incubated for 30 mins by scintillation counting method | ic50 | 0.0039 | uM |
CTD chemical–gene interactions
246 total (human), top 30 by PubMed support.
| Chemical | Actions (top 5) | PubMed papers |
|---|---|---|
| fatostatin | decreases expression, increases response to substance, affects reaction, increases reaction | 8 |
| Benzo(a)pyrene | decreases expression, increases methylation, affects cotreatment, affects expression | 8 |
| T0901317 | affects cotreatment, increases expression, decreases reaction | 7 |
| Valproic Acid | affects reaction, increases expression, affects expression, decreases expression | 7 |
| Oleic Acid | affects cotreatment, decreases expression, decreases reaction, increases expression, affects expression (+1 more) | 7 |
| bisphenol A | affects expression, increases expression | 6 |
| Rosiglitazone | increases expression, affects cotreatment, affects expression, affects reaction, increases activity | 6 |
| perfluorooctanoic acid | affects cotreatment, decreases expression, increases expression | 5 |
| Tretinoin | decreases expression, increases expression | 5 |
| Aflatoxin B1 | decreases expression, decreases methylation, affects expression, affects cotreatment | 5 |
| Palmitic Acid | increases expression, affects cotreatment, affects expression, affects reaction, decreases reaction | 5 |
| sodium arsenite | decreases expression, increases abundance, increases expression, affects cotreatment | 4 |
| cobaltous chloride | decreases expression, increases expression, decreases reaction | 4 |
| Amiodarone | decreases reaction, increases expression, affects reaction, increases uptake, decreases activity | 4 |
| Cyclosporine | affects cotreatment, decreases expression | 4 |
| Genistein | decreases expression, increases expression | 4 |
| mono-(2-ethylhexyl)phthalate | affects expression, increases expression | 3 |
| perfluorobutyric acid | affects cotreatment, decreases expression, increases expression | 3 |
| cylindrospermopsin | decreases expression | 3 |
| Fluorouracil | decreases expression, increases expression, affects response to substance, decreases reaction | 3 |
| Tetrachlorodibenzodioxin | decreases expression, increases expression | 3 |
| Particulate Matter | increases abundance, increases expression, affects cotreatment, decreases expression | 3 |
| betulin | decreases expression | 2 |
| benzo(b)fluoranthene | affects cotreatment, decreases expression, affects expression | 2 |
| ochratoxin A | decreases expression | 2 |
| potassium chromate(VI) | affects cotreatment, increases expression | 2 |
| cupric chloride | decreases expression | 2 |
| perfluorodecanoic acid | affects reaction, increases expression, affects cotreatment | 2 |
| perfluoro-n-heptanoic acid | increases expression | 2 |
| GW 7647 | affects cotreatment, decreases expression, increases expression | 2 |
ChEMBL screening assays
83 unique, capped per target: 74 binding, 8 admet, 1 unclassified
Representative assays (with source publication via chembl_document):
| Assay ID | Type | Description | Source paper |
|---|---|---|---|
| CHEMBL1010955 | Binding | Inhibition of Delta-9-desaturase in human HepG2 cells | Novel, potent, selective, and metabolically stable stearoyl-CoA desaturase (SCD) inhibitors. — Bioorg Med Chem Lett |
| CHEMBL4626519 | ADMET | Inhibition of SCD in human H2009 cells non-expressing CYP4F11 assessed as reduction in cell viability incubated for 96 hrs by cell titer Glo reagent based assay | Tumor-Activated Benzothiazole Inhibitors of Stearoyl-CoA Desaturase. — J Med Chem |
| CHEMBL4626521 | Unclassified | Selectivity index, ratio of IC50 for inhibition of SCD in human H2009 cells non-expressing CYP4F11 to IC50 for inhibition of SCD in human NCI-H2122 cells expressing CYP4F11 | Tumor-Activated Benzothiazole Inhibitors of Stearoyl-CoA Desaturase. — J Med Chem |
Cellosaurus cell lines
1 cell lines: 1 cancer cell line
First 10 cell lines (id-ordered, not curated):
| Cellosaurus | Name | Category | Sex |
|---|---|---|---|
| CVCL_B2EP | Abcam HeLa SCD KO | Cancer cell line | Female |
Clinical trials (associated diseases)
48 trials via MONDO — disease-level, not drug-specific.
| Trial | Phase | Status | Title |
|---|---|---|---|
| NCT05003648 | PHASE4 | ACTIVE_NOT_RECRUITING | Treating Leg Symptoms in Women With X-linked Adrenoleukodystrophy |
| NCT00007020 | PHASE3 | COMPLETED | Compassionate Treatment of Patients With Inborn Errors of Bile Acid Metabolism With Cholic Acid |
| NCT00545597 | PHASE3 | TERMINATED | A Phase III Trial of Lorenzo’s Oil in Adrenomyeloneuropathy |
| NCT00004418 | PHASE2 | TERMINATED | Effect of Glycerol Trierucate on Clinical Course of Adrenoleukodystrophy |
| NCT00383448 | PHASE2 | COMPLETED | HSCT for High Risk Inherited Inborn Errors |
| NCT01043640 | PHASE2 | COMPLETED | Allogeneic Bone Marrow Transplant for Inherited Metabolic Disorders |
| NCT03864523 | PHASE2 | COMPLETED | Effect of Pioglitazone Administered to Patients With Adrenomyeloneuropathy |
| NCT05200104 | PHASE2 | WITHDRAWN | Study to Assess PXL065 in Subjects With Adrenomyeloneuropathy (AMN) Form of X-linked Adrenoleukodystrophy (X-ALD or ALD) |
| NCT01586455 | PHASE1 | COMPLETED | Human Placental-Derived Stem Cell Transplantation |
| NCT01787578 | PHASE1 | WITHDRAWN | Safety and Pharmacodynamic Study of Sobetirome in X-Linked Adrenoleukodystrophy (X-ALD) |
| NCT02254863 | PHASE1 | RECRUITING | UCB Transplant of Inherited Metabolic Diseases With Administration of Intrathecal UCB Derived Oligodendrocyte-Like Cells |
| NCT02595489 | PHASE1 | COMPLETED | A Pilot Study of Vitamin D in Boys With X-linked Adrenoleukodystrophy |
| NCT00176904 | PHASE2/PHASE3 | COMPLETED | Stem Cell Transplant for Inborn Errors of Metabolism |
| NCT02961803 | PHASE2/PHASE3 | COMPLETED | MD1003-AMN MD1003 in Adrenomyeloneuropathy |
| NCT03231878 | PHASE2/PHASE3 | COMPLETED | A Clinical Study to Evaluate the Efficacy and Safety of MIN-102 (IMP) in Male AMN Patients. |
| NCT04303416 | PHASE2/PHASE3 | COMPLETED | Plasma Exchange With Albumin in AMN Patients |
| NCT01372228 | PHASE1/PHASE2 | TERMINATED | Phase I/II Pilot Study of Mixed Chimerism to Treat Inherited Metabolic Disorders |
| NCT02559830 | PHASE1/PHASE2 | UNKNOWN | Autologous Hematopoietic Stem Cell Gene Therapy for Metachromatic Leukodystrophy and Adrenoleukodystrophy |
| NCT03196765 | PHASE1/PHASE2 | WITHDRAWN | Safety, Pharmacokinetics and Pharmacodynamics of NV1205 in Pediatric Male Subjects With Adrenoleukodystrophy |
| NCT03513328 | PHASE1/PHASE2 | COMPLETED | Conditioning Regimen for Allogeneic Hematopoietic Stem-Cell Transplantation |
| NCT05394064 | PHASE1/PHASE2 | TERMINATED | A Study to Evaluate Administration of SBT101 Gene Therapy in Adult Patients With Adrenomyeloneuropathy (AMN) |
| NCT00004442 | Not specified | TERMINATED | Study of Bile Acids in Patients With Peroxisomal Disorders |
| NCT00004450 | Not specified | COMPLETED | Randomized Study of Beta Interferon and Thalidomide in Patients With Adrenoleukodystrophy |
| NCT00005900 | Not specified | UNKNOWN | Study of Pulmonary Complications in Pediatric Patients With Storage Disorders Undergoing Allogeneic Hematopoietic Stem Cell Transplantation |
| NCT00278044 | Not specified | UNKNOWN | Clinical Study and Gene Mutation Analysis of Adrenoleukodystrophy in Taiwanese Children |
| NCT01165060 | Not specified | COMPLETED | The Effect of Bezafibrate on the Level of Very Long Chain Fatty Acids (VLCFA) in X-linked Adrenoleukodystrophy (X-ALD) |
| NCT01594853 | Not specified | COMPLETED | Exercise Study of Function and Pathology for Women With X-linked Adrenoleukodystrophy |
| NCT02204904 | Not specified | TERMINATED | Observational Study to Evaluate Allogeneic HSCT Outcomes for Cerebral Adrenoleukodystrophy (CALD) |
| NCT02233257 | Not specified | NO_LONGER_AVAILABLE | Expanded Access for Lorenzo’s Oil (GTO/GTE) in Adrenoleukodystrophy |
| NCT02698579 | Not specified | ACTIVE_NOT_RECRUITING | Long-term Follow-up of Participants With Cerebral Adrenoleukodystrophy Who Were Treated With Lenti-D Drug Product |
| NCT02699190 | Not specified | COMPLETED | LeukoSEQ: Whole Genome Sequencing as a First-Line Diagnostic Tool for Leukodystrophies |
| NCT02948062 | Not specified | WITHDRAWN | Early Diagnosis Of Childhood Cerebral ALD |
| NCT02952482 | Not specified | COMPLETED | Newborn Screening for Adrenoleukodystrophy |
| NCT03047369 | Not specified | RECRUITING | The Myelin Disorders Biorepository Project |
| NCT03278899 | Not specified | UNKNOWN | A Study to Prospectively Assess Disease Progression in Male Children With X-ALD |
| NCT03333200 | Not specified | RECRUITING | Longitudinal Study of Neurodegenerative Disorders |
| NCT03649919 | Not specified | WITHDRAWN | Multi-center Clinical Study on the Diagnosis and Treatment Management of Rare Neurological Disease in Children |
| NCT03727555 | Not specified | RECRUITING | IT and IV Lentiviral Gene Therapy for X-ALD |
| NCT03789721 | Not specified | RECRUITING | Adrenoleukodystrophy National Registry Study |
| NCT04090268 | Not specified | UNKNOWN | Precision Exercise in Children With Malignant Hemopathies |
Related Atlas pages
- Associated diseases: X-linked cerebral adrenoleukodystrophy
- Disease cohort memberships (association, not causation — diseases whose associated-gene cohort lists this gene; a subset are also under Associated diseases): adrenoleukodystrophy