Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | HTR2B | P41595 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | ADH5 | P11766 | 4/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.33 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.33 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10895581 | 0.90 | ADH5 (0.44) | CYP3A4BAZ2BMAPTHTTHTR2A | |
| SCHEMBL10893218 | 0.84 | LMNA (0.46) | CYP3A4BAZ2BMAPTHTTTBXAS1 | |
| SCHEMBL10893883 | 0.82 | ENPP2 (0.41) | CYP3A4BAZ2B | |
| SCHEMBL10895664 | 0.81 | ADH5 (0.45) | CYP3A4BAZ2BMAPTHTTHTR2A | |
| SCHEMBL10895792 | 0.79 | CYP11B1 (0.48) | CYP3A4MAPTTBXAS1CYP2C19CYP1A2 | |
| SCHEMBL10897054 | 0.78 | KDM4E (0.41) | CYP3A4TBXAS1CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL10897048 | 0.78 | KDM4E (0.41) | CYP3A4TBXAS1CYP2C19CYP1A2CYP2D6 | |
| SCHEMBL10895829 | 0.78 | ALOX5 (0.37) | CYP3A4TBXAS1ALOX5 | |
| SCHEMBL10896503 | 0.76 | CYP11B2 (0.41) | CYP3A4MAPTCYP2C19CYP1A2CYP2D6 | |
| SCHEMBL10898083 | 0.76 | ADH5 (0.42) | CYP3A4BAZ2BHTTHTR2AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4602022-A | VASODILATORS, ANTIAGGREGANT AGENTS, ANTIINFLAMMATORY AND HYPOTENSIVE AGENTS | FARMITALIA CARLO ERBA, S.P.A. (IT) | 1986-07-22 | — | — | US | disclosed |
| US-4510149-A | VASODILATORS, HYPOTENSIVE AGENTS, ANTIARTHRITIC AGENTS | FARMITALIA CARLO ERBA S.P.A. (IT) | 1985-04-09 | — | — | US | disclosed |