Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACP3 | P15309 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 4/20 | 0.38 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 2/20 | 0.35 |
| ▸ | PPARA | Q07869 | 2/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4661478 | 0.88 | ACP3 (0.41) | ACP3ALDH1A1HPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL4661572 | 0.88 | ALDH1A1 (0.39) | ALDH1A1HPGDSMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL4663676 | 0.87 | ALDH1A1 (0.43) | ACP3ALDH1A1HPGDCYP2C9CYP2C19 | |
| SCHEMBL4661637 | 0.86 | CMA1 (0.42) | ACP3ALDH1A1HPGDCYP2C9CYP2C19 | |
| SCHEMBL4660270 | 0.85 | MEN1 (0.40) | ALDH1A1HPGDSMN1; SMN2CYP2C9CYP2C19 | |
| SCHEMBL4661578 | 0.85 | MAPT (0.42) | ALDH1A1HPGDMCL1 | |
| SCHEMBL4660079 | 0.85 | SMN1; SMN2 (0.41) | ACP3ALDH1A1HPGDSMN1; SMN2PPARG | |
| SCHEMBL4660208 | 0.84 | CYP2C9 (0.45) | ACP3ALDH1A1HPGDCYP2C9CYP2C19 | |
| SCHEMBL4127559 | 0.81 | ALDH1A1 (0.51) | ACP3ALDH1A1HPGDSMN1; SMN2CYP2C9 | |
| SCHEMBL4660088 | 0.80 | ALDH1A1 (0.41) | ALDH1A1HPGDCYP2C9CYP2C19PTGES |
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 |
|---|---|---|---|---|---|---|---|
| EP-1620102-B1 | 3-(1-NAPHTHYL)-2-CYANOPROPANOIC ACID DERIVATIVES AS ESTROGEN RECEPTOR LIGANDS | WYETH CORP (US) | 2008-12-24 | — | — | EP | claimed |