Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.57 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.51 |
| ▸ | SHBG | P04278 | 4/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.48 |
| ▸ | PGR | P06401 | 2/20 | 0.48 |
| ▸ | SERPINA6 | P08185 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | GPBAR1 | Q8TDU6 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.48 |
| ▸ | MGAM | O43451 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SNCA | P37840 | 1/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.46 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4265769 | 1.00 | AR (0.57) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL13656789 | 1.00 | AR (0.57) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL4263690 | 1.00 | AR (0.57) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL4263685 | 1.00 | AR (0.57) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL5071065 | 1.00 | AR (0.57) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL4268861 | 0.86 | AR (0.58) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL7618270 | 0.86 | AR (0.58) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL6401831 | 0.86 | AR (0.58) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL4268866 | 0.86 | AR (0.58) | ARCYP19A1SHBGHSD17B10NR3C1 | |
| SCHEMBL7618262 | 0.86 | AR (0.58) | ARCYP19A1SHBGHSD17B10NR3C1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7605152-B2 | 17-hydroxy-4-aza-androstan-3-ones as androgen receptor modulators | MERCK & CO., INC. (US) | 2009-10-20 | — | — | US | disclosed |
| US-7605152-B2 | 17-hydroxy-4-aza-androstan-3-ones as androgen receptor modulators | MERCK & CO., INC. (US) | 2009-10-20 | — | — | US | disclosed |