Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.32 |
| ▸ | STS | P08842 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.30 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.30 |
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8707336 | 0.74 | MBOAT4 (0.39) | SHBGCYP19A1CYP3A4MBOAT4 | |
| SCHEMBL7611435 | 0.71 | MBOAT4 (0.33) | STSMBOAT4 | |
| SCHEMBL8080471 | 0.68 | MBOAT4 (0.34) | CYP19A1MBOAT4 | |
| SCHEMBL5183889 | 0.66 | SRD5A1 (0.53) | CYP19A1 | |
| SCHEMBL5183886 | 0.66 | SRD5A1 (0.53) | CYP19A1 | |
| SCHEMBL8710300 | 0.63 | CYP19A1 (0.40) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL7475323 | 0.62 | TDP1 (0.44) | CYP19A1CYP3A4CYP2C9CYP2C19TDP1 | |
| SCHEMBL8707384 | 0.62 | TDP1 (0.49) | CYP19A1ARCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL10738737 | 0.62 | LMNA (0.46) | — | |
| SCHEMBL1902709 | 0.61 | CYP19A1 (0.40) | CYP19A1MBOAT4 |
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-0880540-A1 | 17-BETA-CYCLOPROPYL(AMINO/OXY) 4-AZA STEROIDS AS ACTIVE INHIBITORS OF TESTOSTERONE 5-ALPHA-REDUCTASE AND C17-20-LYASE | HOECHST MARION ROUSSEL, INC. (US) | 1998-12-02 | — | — | EP | disclosed |
| WO-1997030069-A1 | 17-BETA-CYCLOPROPYL(AMINO/OXY) 4-AZA STEROIDS AS ACTIVE INHIBITORS OF TESTOSTERONE 5-ALPHA-REDUCTASE AND C17-20-LYASE | HOECHST MARION ROUSSEL, INC. (US) | 1997-08-21 | — | — | WO | disclosed |