Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 4/20 | 0.41 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.41 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.40 |
| ▸ | PPARA | Q07869 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 4/20 | 0.39 |
| ▸ | CPB1 | P15086 | 1/20 | 0.39 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | CTSS | P25774 | 2/20 | 0.38 |
| ▸ | CTSL | P07711 | 1/20 | 0.38 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | CTSK | P43235 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3009900 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL24997209 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL3428546 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL3009904 | 0.83 | ITGB3 (0.47) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL3008889 | 0.81 | ITGB3 (0.45) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL3008885 | 0.81 | ITGB3 (0.45) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL13650201 | 0.81 | ITGB3 (0.45) | ITGB3ITGA2BACECPB2ITGA4 | |
| Benzene SCHEMBL29402026 | 0.81 | ACE (0.47) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL6329225 | 0.80 | CPB2 (0.64) | ITGB3ITGA2BACECPB2ITGA4 | |
| SCHEMBL3838443 | 0.79 | CPB2 (0.53) | ITGB3ITGA2BACECPB2PTPN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1613600-B1 | SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE OF THE SAME AS MEDICAMENTS, AND MEDICAMENT CONTAINING SUCH COMPOUNDS | SANOFI AVENTIS DEUTSCHLAND (DE) | 2015-12-23 | — | — | EP | disclosed |
| EP-1613600-A1 | SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE OF THE SAME AS MEDICAMENTS, AND MEDICAMENT CONTAINING SUCH COMPOUNDS | Sanofi-Aventis Deutschland GmbH (DE) | 2006-01-11 | — | — | EP | disclosed |
| WO-2004085404-A1 | SUBSTITUTED 4-PHENYLTETRAHYDROISOQUINOLINES, METHOD FOR THE PRODUCTION THEREOF, THE USE OF THE SAME AS MEDICAMENTS, AND MEDICAMENT CONTAINING SUCH COMPOUNDS | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2004-10-07 | — | — | WO | disclosed |