Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A2 | P31213 | 6/20 | 0.42 |
| ▸ | SRD5A1 | P18405 | 5/20 | 0.42 |
| ▸ | AR | P10275 | 1/20 | 0.39 |
| ▸ | SHBG | P04278 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8006977 | 0.92 | SRD5A2 (0.44) | SRD5A2SRD5A1ARSHBG | |
| SCHEMBL8016713 | 0.85 | SRD5A2 (0.52) | SRD5A2SRD5A1AR | |
| SCHEMBL8021051 | 0.84 | SRD5A2 (0.42) | SRD5A2SRD5A1ARSHBG | |
| SCHEMBL8016817 | 0.84 | SRD5A2 (0.43) | SRD5A2SRD5A1ARSHBG | |
| SCHEMBL8018786 | 0.84 | SRD5A2 (0.43) | SRD5A2SRD5A1ARSHBG | |
| SCHEMBL8017027 | 0.82 | SRD5A1 (0.43) | SRD5A2SRD5A1SHBG | |
| SCHEMBL8016704 | 0.78 | SRD5A2 (0.52) | SRD5A2SRD5A1AR | |
| SCHEMBL8017034 | 0.77 | SRD5A2 (0.47) | SRD5A2SRD5A1AR | |
| SCHEMBL8016230 | 0.77 | SRD5A2 (0.47) | SRD5A2SRD5A1AR | |
| SCHEMBL8018473 | 0.72 | SRD5A2 (0.54) | SRD5A2SRD5A1AR |
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-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 |