Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 18/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11533747 | 0.90 | CYP19A1 (0.74) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL11533748 | 0.90 | CYP19A1 (0.74) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL6746497 | 0.87 | CYP19A1 (0.72) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL4448095 | 0.85 | CYP19A1 (0.79) | CYP19A1CYP3A4CYP1B1 | |
| SCHEMBL29882586 | 0.84 | CYP19A1 (0.65) | CYP19A1CYP3A4CYP1B1 | |
| SCHEMBL8466445 | 0.84 | CYP19A1 (0.67) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL1560756 | 0.83 | CYP19A1 (0.77) | CYP19A1CYP3A4CYP1B1 | |
| SCHEMBL15846851 | 0.83 | CYP19A1 (0.49) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL6745364 | 0.82 | CYP19A1 (0.65) | CYP19A1CYP3A4CYP1B1 | |
| SCHEMBL8532535 | 0.82 | CYP19A1 (0.75) | CYP19A1CYP3A4CYP1B1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2300489-A1 | METHODS FOR PREPARING 17-ALKYNYL-7-HYDROXY STEROIDS AND RELATED COMPOUNDS | Harbor BioSciences, Inc. (US) | 2011-03-30 | — | — | EP | disclosed |
| WO-2009149392-A1 | METHODS FOR PREPARING 17-ALKYNYL-7-HYDROXY STEROIDS AND RELATED COMPOUNDS | HOLLIS-EDEN PHARMACEUTICALS, INC. (US) | 2009-12-10 | — | — | WO | disclosed |
| EP-0700291-A4 | 15-SUBSTITUTED 4-AZASTEROIDS | MERCK & CO INC (US) | 1996-07-03 | — | — | EP | disclosed |
| EP-0700291-A1 | 15-SUBSTITUTED 4-AZASTEROIDS | MERCK & CO. INC. (US) | 1996-03-13 | — | — | EP | disclosed |
| WO-1994020104-A1 | 15-SUBSTITUTED 4-AZASTEROIDS | MERCK & CO, INC. (US) | 1994-09-15 | — | — | WO | disclosed |