Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 5/20 | 0.34 |
| ▸ | LMNA | P02545 | 5/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.34 |
| ▸ | TSHR | P16473 | 4/20 | 0.34 |
| ▸ | AR | P10275 | 4/20 | 0.34 |
| ▸ | MAPT | P10636 | 4/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.34 |
| ▸ | PGR | P06401 | 3/20 | 0.34 |
| ▸ | SERPINA6 | P08185 | 3/20 | 0.34 |
| ▸ | GPBAR1 | Q8TDU6 | 3/20 | 0.34 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.34 |
| ▸ | SNCA | P37840 | 2/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.34 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.34 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9596200 | 0.85 | LMNA (0.41) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9127953 | 0.83 | SHBG (0.36) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9127951 | 0.83 | SHBG (0.36) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9125173 | 0.81 | SHBG (0.52) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9125165 | 0.81 | SHBG (0.52) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9125169 | 0.81 | SHBG (0.52) | SHBGLMNACYP3A4CYP19A1TSHR | |
| SCHEMBL9463992 | 0.76 | NR3C1 (0.39) | SHBGLMNACYP3A4ARMAPT | |
| SCHEMBL9463791 | 0.76 | NR3C1 (0.39) | SHBGLMNACYP3A4ARMAPT | |
| SCHEMBL9463993 | 0.76 | NR3C1 (0.39) | SHBGLMNACYP3A4ARMAPT | |
| SCHEMBL9125308 | 0.74 | SHBG (0.39) | SHBGLMNACYP3A4CYP19A1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0538312-A1 | Anti-androgenic [3,2-d]triazole steroids | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-04-28 | — | — | EP | disclosed |
| WO-1992000992-A1 | ANTI-ANDROGENIC [3,2-c]PYRAZOLE AND [3,2-d]TRIAZOLE STEROIDS | SCHERING AKTIENGESELLSCHAFT BERLIN UND BERGKAMEN (DE) | 1992-01-23 | — | — | WO | disclosed |