Known targets — ChEMBL curated mechanism
ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol
The experimentally established mechanism targets of Maleic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.53 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | TNKS | O95271 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.50 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.50 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.45 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.45 |
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 SCHEMBL29876027 | 0.97 | TSHR (0.58) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Fumaric Acid SCHEMBL21145251 | 0.97 | TSHR (0.58) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Fumaric Acid SCHEMBL21145252 | 0.97 | TSHR (0.58) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Maleic Acid SCHEMBL28558115 | 0.95 | TSHR (0.55) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Aniline SCHEMBL11503542 | 0.89 | NPSR1 (0.48) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Maleic Acid SCHEMBL11361008 | 0.82 | SMN1; SMN2 (0.53) | TSHRNPSR1HCAR2HDAC3TNKS | |
| Aniline SCHEMBL6049858 | 0.81 | TSHR (0.73) | TSHRCYP1B1ALDH1A1KDM4EMAPT | |
| Aniline SCHEMBL8413315 | 0.81 | TSHR (0.73) | TSHRCYP1B1ALDH1A1KDM4EMAPT | |
| Aniline SCHEMBL16859322 | 0.80 | TSHR (0.55) | TSHRNPSR1HCAR2HDAC3TNKS | |
| 4-Phenoxyaniline SCHEMBL3318254 | 0.79 | MAOA (0.69) | TSHRALDH1A1KDM4EMAPTLMNA |
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-2020162402-A1 | SKIN COMPOSITION | マルホ株式会社 | 2020-08-13 | — | — | WO | disclosed |