Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | SRD5A2 | P31213 | 4/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | SHBG | P04278 | 2/20 | 0.32 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | SERPINA6 | P08185 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | MGAM | O43451 | 1/20 | 0.32 |
| ▸ | FGF2 | P09038 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8927180 | 0.81 | AR (0.36) | ARKCNH2SRD5A2CYP17A1KDM4E | |
| SCHEMBL8925124 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL8927213 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL8927179 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL8927210 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL9546871 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL8925120 | 0.72 | SRD5A1 (0.57) | — | |
| SCHEMBL8726328 | 0.71 | CYP19A1 (0.43) | SRD5A2SHBGCYP19A1 | |
| SCHEMBL9546872 | 0.70 | SRD5A2 (0.58) | ARSRD5A2 | |
| SCHEMBL8926912 | 0.68 | SRD5A2 (0.34) | ARKCNH2SRD5A2MAPT |
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 |