Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol
The experimentally established mechanism targets of Fumaric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 known ✓ | Q9Y5N1 | 4/20 | 0.51 |
| ▸ | KCNH2 known ✓ | Q12809 | 2/20 | 0.51 |
| ▸ | SLC6A2 known ✓ | P23975 | 1/20 | 0.36 |
| ▸ | SLC6A4 known ✓ | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 known ✓ | Q01959 | 1/20 | 0.36 |
| ▸ | CACNA1G | O43497 | 5/20 | 0.52 |
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | ELANE | P08246 | 2/20 | 0.43 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Maleic Acid SCHEMBL7424004 | 1.00 | CACNA1G (0.52) | CACNA1GHRH3KCNH2GSK3BELANE | |
| SCHEMBL7427115 | 0.92 | HRH3 (0.57) | CACNA1GHRH3KCNH2GSK3BELANE | |
| SCHEMBL7421852 | 0.91 | HRH3 (0.59) | CACNA1GHRH3KCNH2GSK3BELANE | |
| Fumaric Acid SCHEMBL7427567 | 0.88 | HRH3 (0.49) | CACNA1GHRH3KCNH2ELANEKDM4E | |
| Maleic Acid SCHEMBL7427563 | 0.88 | HRH3 (0.49) | CACNA1GHRH3KCNH2ELANEKDM4E | |
| SCHEMBL10055070 | 0.81 | CACNA1G (0.53) | CACNA1GHRH3KCNH2GSK3BELANE | |
| SCHEMBL7423841 | 0.80 | HRH3 (0.55) | CACNA1GHRH3KCNH2ELANEKDM4E | |
| SCHEMBL7430392 | 0.79 | CACNA1G (0.61) | CACNA1GKCNH2GSK3BALDH1A1 | |
| SCHEMBL7424821 | 0.79 | HRH3 (0.59) | CACNA1GHRH3KCNH2GSK3BELANE | |
| SCHEMBL3387830 | 0.79 | HRH3 (0.57) | CACNA1GHRH3KCNH2ELANEKDM4E |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2000053589-A1 | PROCESS FOR PREPARING OXAZOLE DERIVATIVES | GLAXO GROUP LIMITED (GB) | 2000-09-14 | — | — | WO | disclosed |