Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 15/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 12/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.45 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | HSD3B1 | P14060 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | THPO | P40225 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8019151 | 0.92 | SRD5A1 (0.46) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8016924 | 0.86 | SRD5A1 (0.47) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8023753 | 0.85 | SRD5A1 (0.64) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8023737 | 0.82 | SRD5A1 (0.53) | SRD5A1SRD5A2 | |
| SCHEMBL8020673 | 0.78 | SRD5A1 (0.39) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8007033 | 0.77 | SRD5A1 (0.75) | SRD5A1SRD5A2 | |
| SCHEMBL8016749 | 0.77 | SRD5A1 (0.65) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 | |
| SCHEMBL8017035 | 0.76 | SRD5A2 (0.44) | SRD5A1SRD5A2 | |
| SCHEMBL8019140 | 0.73 | SRD5A1 (0.54) | SRD5A1SRD5A2 | |
| SCHEMBL8019154 | 0.73 | SRD5A1 (0.38) | SRD5A1SRD5A2LMNACYP3A4CYP2C9 |
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-0664812-B1 | 17-BETA-ARYL ESTER CARBOXYLATES OF 4-AZA-5-ALPHA-ANDROSTANE-3-ONES | MERCK & CO INC (US) | 2000-01-05 | — | — | EP | disclosed |
| US-5278159-A | Steroid enzyme inhibitor | MERCK & CO., INC. (US) | 1994-01-11 | — | — | US | disclosed |