Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 16/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 16/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 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 | |
|---|---|---|---|---|
| SCHEMBL7931556 | 1.00 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| SCHEMBL7924895 | 1.00 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| SCHEMBL7924899 | 1.00 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7363298 | 0.92 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7363292 | 0.92 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7364908 | 0.92 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7363302 | 0.92 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| SCHEMBL7444700 | 0.91 | ITGB3 (0.45) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| SCHEMBL7372928 | 0.89 | ITGB3 (0.44) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7370143 | 0.89 | ITGB3 (0.43) | ITGB3ITGA2BCASP1CYP3A4CYP2D6 |
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-6242600-B1 | ANTIISCHEMIC AGENTS, ANTICOAGULANTS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2001-06-05 | — | — | US | disclosed |