Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.39 |
| ▸ | VCP | P55072 | 1/20 | 0.36 |
| ▸ | F10 | P00742 | 6/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.35 |
| ▸ | GPX4 | P36969 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL6990601 | 0.81 | USP30 (0.31) | MCHR1 | |
| SCHEMBL7704575 | 0.73 | CYP19A1 (0.43) | CYP19A1VCP | |
| SCHEMBL1878657 | 0.73 | CYP19A1 (0.55) | CYP19A1VCPKDM4E | |
| SCHEMBL6985367 | 0.69 | CYP19A1 (0.39) | CYP19A1VCPGPX4APPKDM4E | |
| SCHEMBL7240009 | 0.69 | EPHX2 (0.59) | CYP19A1VCPKDM4E | |
| SCHEMBL6987190 | 0.68 | ALDH1A1 (0.54) | CYP19A1KDM4ERAB9A | |
| SCHEMBL10398544 | 0.67 | NPC1 (0.41) | CYP19A1KDM4ENPC1RAB9A | |
| SCHEMBL6989729 | 0.66 | ROCK1 (0.53) | NPC1RAB9A | |
| SCHEMBL22789633 | 0.64 | CYP19A1 (0.41) | CYP19A1VCPAPPKDM4E | |
| SCHEMBL22763428 | 0.63 | CYP19A1 (0.40) | CYP19A1VCP |
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-1303508-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | Boehringer Ingelheim Pharmaceuticals, Inc. (US) | 2003-04-23 | — | — | EP | claimed |
| WO-2002006273-A1 | SUBSTITUTED 1-(4-AMINOPHENYL)INDOLES AND THEIR USE AS ANTI-INFLAMMATORY AGENTS | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) | 2002-01-24 | — | — | WO | claimed |
| US-6353007-B1 | ANTIINFLAMMATORY AGENTS AND INHIBITORS OF CELLULAR POLIFERATION | BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. | 2002-03-05 | — | — | US | disclosed |