Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 4/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 3/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9546870 | 1.00 | SRD5A1 (0.56) | SRD5A1CYP2C19SRD5A2CYP19A1CYP17A1 | |
| SCHEMBL9546880 | 0.83 | SRD5A1 (0.56) | SRD5A1CYP2C19SRD5A2CYP19A1 | |
| SCHEMBL9546879 | 0.83 | SRD5A1 (0.56) | SRD5A1CYP2C19SRD5A2CYP19A1 | |
| SCHEMBL9546881 | 0.81 | SRD5A1 (0.56) | SRD5A1SRD5A2CYP19A1CYP17A1 | |
| SCHEMBL9546882 | 0.81 | SRD5A1 (0.56) | SRD5A1SRD5A2CYP19A1CYP17A1 | |
| SCHEMBL8927022 | 0.79 | SRD5A1 (0.51) | SRD5A1CYP2C19SRD5A2 | |
| SCHEMBL7613570 | 0.78 | SRD5A1 (0.67) | SRD5A1CYP19A1 | |
| SCHEMBL7613573 | 0.78 | SRD5A1 (0.67) | SRD5A1CYP19A1 | |
| SCHEMBL3795654 | 0.76 | SRD5A1 (0.61) | SRD5A1CYP19A1 | |
| SCHEMBL7617616 | 0.76 | SRD5A1 (0.61) | SRD5A1CYP19A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993023039-A1 | SUBSTITUTED 4-AZA-5A-ANDROSTAN-ONES AS 5A-REDUCTASE INHIBITORS | MERCK & CO., INC. (US) | 1993-11-25 | — | — | WO | claimed |