Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | HPGD | P15428 | 4/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.62 |
| ▸ | TP53 | P04637 | 2/20 | 0.62 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.62 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.62 |
| ▸ | CKS1B | P61024 | 1/20 | 0.62 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.62 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.54 |
| ▸ | HKDC1 | Q2TB90 | 2/20 | 0.53 |
| ▸ | CCR6 | P51684 | 1/20 | 0.53 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.51 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL8325203 | 0.88 | CYP1A2 (0.57) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8321810 | 0.87 | HSD17B10 (0.65) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8318942 | 0.85 | ALDH1A1 (0.62) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8326087 | 0.83 | ALDH1A1 (0.64) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8326821 | 0.82 | HPGD (0.60) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8323382 | 0.81 | ALDH1A1 (0.61) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8319293 | 0.80 | CYP4A11 (0.60) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10366045 | 0.79 | CA1 (0.57) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL8319038 | 0.79 | ALDH1A1 (0.58) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL10680744 | 0.78 | ALDH1A1 (0.56) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733033-B1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LTD (GB) | 1999-12-22 | — | — | EP | disclosed |
| US-5811459-A | PAIN RELIEVERS | ZENECA LIMITED (GB) | 1998-09-22 | — | — | US | disclosed |
| EP-0733033-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-09-25 | — | — | EP | disclosed |
| WO-1996011902-A1 | PHARMACEUTICALLY ACTIVE SUBSTITUTED AROMATIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-04-25 | — | — | WO | disclosed |