Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.42 |
| ▸ | CDC7 | O00311 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 1/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.40 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.40 |
| ▸ | BIRC5 | O15392 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.40 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | PRKCG | P05129 | 1/20 | 0.39 |
| ▸ | PRKCB | P05771 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | PRKACA | P17612 | 1/20 | 0.39 |
| ▸ | PRKACG | P22612 | 1/20 | 0.39 |
| ▸ | PRKACB | P22694 | 1/20 | 0.39 |
| ▸ | PRKCH | P24723 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.39 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14255230 | 0.87 | MAPT (0.47) | CYP19A1MAPTSLC6A2CDC7CDK2 | |
| SCHEMBL6654310 | 0.82 | CYP11B1 (0.45) | CYP19A1MAPT | |
| SCHEMBL29896751 | 0.79 | BIRC5 (0.47) | MAPTCDC7CDK2ROCK1BIRC5 | |
| SCHEMBL5604900 | 0.79 | BIRC5 (0.47) | MAPTCDC7CDK2ROCK1BIRC5 | |
| SCHEMBL6653678 | 0.79 | SLC6A2 (0.47) | CYP19A1MAPTSLC6A2CDC7CDK2 | |
| SCHEMBL6659505 | 0.78 | HTR6 (0.50) | CYP19A1MAPTCDK2ROCK1PRKD3 | |
| SCHEMBL6845500 | 0.78 | CYP11B1 (0.47) | CYP19A1MAPT | |
| SCHEMBL6660298 | 0.78 | CYP11B2 (0.55) | CYP19A1MAPTMKNK1MKNK2 | |
| SCHEMBL7610161 | 0.77 | CDC7 (0.49) | CYP19A1MAPTSLC6A2CDC7CDK2 | |
| SCHEMBL6840679 | 0.77 | CYP11B1 (0.52) | CYP19A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1432698-A2 | SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS | Bayer Pharmaceuticals Corporation (US) | 2004-06-30 | — | — | EP | disclosed |
| WO-2003027094-A2 | SUBSTITUTED 3-PYRIDYL INDOLES AND INDAZOLES AS C17,20 LYASE INHIBITORS | BAYER PHARMACEUTICALS CORPORATION (US) | 2003-04-03 | — | — | WO | disclosed |