Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 12/20 | 0.51 |
| ▸ | SRD5A1 | P18405 | 11/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.51 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.51 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.51 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.51 |
| ▸ | HSD3B1 | P14060 | 1/20 | 0.51 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | THPO | P40225 | 1/20 | 0.51 |
| ▸ | BLM | P54132 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8023756 | 0.89 | SRD5A1 (0.52) | SRD5A2SRD5A1LMNACYP3A4CYP2C9 | |
| SCHEMBL8006823 | 0.87 | SRD5A1 (0.59) | SRD5A2SRD5A1LMNACYP3A4CYP2C9 | |
| SCHEMBL8019154 | 0.84 | SRD5A1 (0.38) | SRD5A2SRD5A1LMNACYP3A4CYP2C9 | |
| SCHEMBL8016931 | 0.84 | SRD5A1 (0.53) | SRD5A2SRD5A1LMNACYP3A4CYP2C9 | |
| SCHEMBL8895974 | 0.82 | SRD5A1 (0.57) | SRD5A2SRD5A1 | |
| SCHEMBL8007040 | 0.81 | SRD5A1 (0.50) | SRD5A2SRD5A1LMNACYP3A4CYP2C9 | |
| SCHEMBL8007037 | 0.80 | SRD5A1 (0.62) | SRD5A2SRD5A1 | |
| SCHEMBL8023777 | 0.80 | SRD5A1 (0.58) | SRD5A2SRD5A1 | |
| SCHEMBL8023759 | 0.80 | SRD5A2 (0.49) | SRD5A2SRD5A1MAPK1 | |
| SCHEMBL8006820 | 0.80 | SRD5A1 (0.56) | SRD5A2SRD5A1 |
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 6 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 | claimed |
| 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 |
| EP-0664812-A4 | 17 -g(b)-ARYL ESTER CARBOXYLATES OF 4-AZA-5-g(a)-ANDROSTANE-3-ONES. | MERCK & CO INC (US) | 1995-10-25 | — | — | EP | disclosed |
| EP-0664812-A1 | 17 $g(b)-ARYL ESTER CARBOXYLATES OF 4-AZA-5$g(a)-ANDROSTANE-3-ONES | MERCK & CO. INC. (US) | 1995-08-02 | — | — | EP | disclosed |
| WO-1994007860-A1 | 17 β-ARYL ESTER CARBOXYLATES OF 4-AZA-5α-ANDROSTANE-3-ONES | MERCK & CO., INC. (US) | 1994-04-14 | — | — | WO | disclosed |
| US-5278159-A | Steroid enzyme inhibitor | MERCK & CO., INC. (US) | 1994-01-11 | — | — | US | disclosed |