Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SHBG | P04278 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 2/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GUSB | P08236 | 1/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL9123998 | 1.00 | SHBG (0.37) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9125169 | 0.83 | SHBG (0.52) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9125173 | 0.83 | SHBG (0.52) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9125165 | 0.83 | SHBG (0.52) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9126873 | 0.81 | SHBG (0.45) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9126880 | 0.81 | SHBG (0.45) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9544771 | 0.81 | SHBG (0.43) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9128775 | 0.77 | PGR (0.37) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9128772 | 0.77 | PGR (0.37) | SHBGALDH1A1NR3C1PGRADRA1A | |
| SCHEMBL9126598 | 0.76 | SHBG (0.52) | SHBGALDH1A1NR3C1PGRADRA1A |
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-5389624-A | Antiandrogenic [3,2-c]pyrazole and [3,2-d]triazole steroids | SCHERING AKTIENGESELLSCHAFT (DE) | 1995-02-14 | — | — | US | disclosed |
| US-5236912-A | Treating prostate hyperplasia and carcinoma | SCHERING AKTIENGESELLSCHAFT (DE) | 1993-08-17 | — | — | US | disclosed |