Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 6/20 | 0.44 |
| ▸ | ITGA2B | P08514 | 5/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ITGAV | P06756 | 4/20 | 0.40 |
| ▸ | ITGB6 | P18564 | 4/20 | 0.40 |
| ▸ | ITGB5 | P18084 | 3/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.35 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 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 | |
|---|---|---|---|---|
| SCHEMBL6952526 | 0.96 | ITGB3 (0.43) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6953427 | 0.89 | ITGB3 (0.45) | ITGB3ITGA2BCYP3A4ITGAVITGB6 | |
| SCHEMBL7414742 | 0.87 | CYP3A4 (0.47) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6950480 | 0.87 | ITGB3 (0.57) | ITGB3ITGA2BITGAVITGB6ITGB5 | |
| Hydrochloric Acid SCHEMBL7414735 | 0.86 | CYP3A4 (0.46) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL7414738 | 0.86 | CYP3A4 (0.46) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL7393079 | 0.85 | FLT4 (0.41) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 | |
| SCHEMBL6950522 | 0.85 | ITGB3 (0.43) | ITGB3ITGA2BROCK2HTTTBXAS1 | |
| SCHEMBL4924076 | 0.84 | ITGB3 (0.56) | ITGB3ITGA2BITGAVITGB6ITGB5 | |
| SCHEMBL7381192 | 0.83 | CYP3A4 (0.55) | ITGB3ITGA2BCYP3A4CYP2D6CYP2C19 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0804418-B1 | PLATELET AGGREGATION INHIBITORS | SEARLE & CO (US) | 2003-03-26 | — | — | EP | claimed |
| US-5639765-A | OSTEOPOROSIS, PAGET*S DISEASE | G. D. SEARLE & CO. (US) | 1997-06-17 | — | — | US | claimed |
| US-5602155-A | GUANIDINO ALKYL AND PYRIDINE CARBOXYLATE SUBSTITUTED AMIDES | G. D. SEARLE & CO. (US) | 1997-02-11 | — | — | US | claimed |
| WO-1996023771-A2 | PLATELET AGGREGATION INHIBITORS | G.D. SEARLE & CO. (US) | 1996-08-08 | — | — | WO | claimed |
| EP-0804418-B1 | PLATELET AGGREGATION INHIBITORS | SEARLE & CO (US) | 2003-03-26 | — | — | EP | disclosed |
| US-5639765-A | OSTEOPOROSIS, PAGET*S DISEASE | G. D. SEARLE & CO. (US) | 1997-06-17 | — | — | US | disclosed |
| US-5602155-A | GUANIDINO ALKYL AND PYRIDINE CARBOXYLATE SUBSTITUTED AMIDES | G. D. SEARLE & CO. (US) | 1997-02-11 | — | — | US | disclosed |
| WO-1996023771-A2 | PLATELET AGGREGATION INHIBITORS | G.D. SEARLE & CO. (US) | 1996-08-08 | — | — | WO | disclosed |