Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CHKA | P35790 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.41 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.41 |
| ▸ | DHFR | P00374 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8838107 | 0.98 | HRH3 (0.47) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| SCHEMBL8635008 | 0.88 | ITGB3 (0.44) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| SCHEMBL8837938 | 0.88 | CHKA (0.47) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| Hydrochloric Acid SCHEMBL8837976 | 0.87 | ITGB3 (0.43) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| Hydrochloric Acid SCHEMBL8838098 | 0.86 | CHKA (0.46) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| SCHEMBL8838198 | 0.85 | GAA (0.44) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| SCHEMBL8637100 | 0.85 | HRH3 (0.44) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| Hydrochloric Acid SCHEMBL8837971 | 0.85 | HRH3 (0.44) | HRH3ITGB3ITGA2BCYP2C9TSHR | |
| SCHEMBL8837943 | 0.84 | ITGB3 (0.48) | HRH3ITGB3ITGA2BHIF1ACHKA | |
| SCHEMBL8838126 | 0.83 | CYP2C9 (0.51) | HRH3ITGB3ITGA2BCYP2C9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5700801-A | ANTIINFLAMMATORY AGENTS, BONE DISORDERS | KARL THOMAE, GMBH (DE) | 1997-12-23 | — | — | US | disclosed |