Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 13/20 | 0.46 |
| ▸ | AR | P10275 | 4/20 | 0.42 |
| ▸ | SHBG | P04278 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 3/20 | 0.38 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL10946739 | 1.00 | CYP19A1 (0.46) | CYP19A1ARSHBGPGRNR3C2 | |
| SCHEMBL7947167 | 0.85 | CYP19A1 (0.50) | CYP19A1ARSHBGPGRNR3C2 | |
| SCHEMBL10596342 | 0.82 | CYP19A1 (0.60) | CYP19A1SHBG | |
| SCHEMBL10596334 | 0.82 | CYP19A1 (0.60) | CYP19A1SHBG | |
| SCHEMBL10945246 | 0.82 | CYP19A1 (0.60) | CYP19A1SHBG | |
| SCHEMBL10949444 | 0.76 | PGR (0.51) | ARSHBGPGRNR3C2CYP3A4 | |
| SCHEMBL13216950 | 0.76 | CYP19A1 (0.67) | CYP19A1ARSHBGPGRNR3C2 | |
| SCHEMBL5157184 | 0.76 | CYP19A1 (0.67) | CYP19A1ARSHBGPGRNR3C2 | |
| SCHEMBL5017877 | 0.76 | CYP19A1 (0.67) | CYP19A1ARSHBGPGRNR3C2 | |
| SCHEMBL29008753 | 0.76 | CYP19A1 (0.67) | CYP19A1ARSHBGPGRNR3C2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4557867-A | CONTRACEPTIVES | THE UPJOHN COMPANY (US) | 1985-12-10 | — | — | US | claimed |
| EP-0145493-A2 | 11-Difluoromethyl and 11-fluoromethylene steroids | THE UPJOHN COMPANY (US) | 1985-06-19 | — | — | EP | disclosed |