Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 3/20 | 0.42 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.41 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.41 |
| ▸ | HSD17B7 | P56937 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8996738 | 0.89 | SRD5A1 (0.46) | SRD5A1SRD5A2HSD17B7 | |
| SCHEMBL8679098 | 0.82 | SRD5A1 (0.39) | SRD5A1SRD5A2HSD17B7 | |
| SCHEMBL7802581 | 0.81 | SRD5A1 (0.58) | SRD5A1SRD5A2 | |
| SCHEMBL7527164 | 0.81 | SRD5A1 (0.58) | SRD5A1SRD5A2 | |
| SCHEMBL8682901 | 0.81 | SRD5A1 (0.35) | SRD5A1SRD5A2GRIN1GRIN2B | |
| SCHEMBL29843057 | 0.78 | CYP19A1 (0.44) | SRD5A1SRD5A2 | |
| SCHEMBL9318018 | 0.78 | CYP19A1 (0.44) | SRD5A1SRD5A2 | |
| SCHEMBL8585461 | 0.76 | SRD5A1 (0.44) | SRD5A1SRD5A2GRIN1GRIN2B | |
| SCHEMBL8679334 | 0.72 | SRD5A1 (0.33) | SRD5A1SRD5A2HSD17B7 | |
| SCHEMBL9152806 | 0.72 | SRD5A2 (0.50) | SRD5A2GRIN1GRIN2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1998009632-A1 | METHODS AND COMPOSITIONS FOR TREATING PRETERM LABOR | MERCK & CO., INC. (US) | 1998-03-12 | — | — | WO | claimed |
| EP-0724592-A1 | 16-SUBSTITUTED-4-AZA-ANDROSTANE 5-ALPHA-REDUCTASE ISOZYME 1 INHIBITORS | MERCK & CO. INC. (US) | 1996-08-07 | — | — | EP | disclosed |
| WO-1995011254-A1 | 16-SUBSTITUTED-4-AZA-ANDROSTANE 5-ALPHA-REDUCTASE ISOZYME 1 INHIBITORS | MERCK & CO., INC. (US) | 1995-04-27 | — | — | WO | disclosed |