Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 5/20 | 0.33 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.31 |
| ▸ | AR | P10275 | 5/20 | 0.31 |
| ▸ | ESR1 | P03372 | 2/20 | 0.31 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5891654 | 1.00 | AKR1C3 (0.34) | AKR1C3PGRNR3C1ARESR1 | |
| SCHEMBL5891671 | 0.97 | AKR1C3 (0.33) | AKR1C3PGRNR3C1AR | |
| SCHEMBL6864127 | 0.90 | AKR1C3 (0.33) | AKR1C3PGR | |
| SCHEMBL5892062 | 0.87 | AR (0.42) | PGRNR3C1ARCYP3A4 | |
| SCHEMBL8768216 | 0.85 | AKR1C3 (0.32) | AKR1C3 | |
| SCHEMBL5891664 | 0.85 | AKR1C3 (0.46) | AKR1C3ESR1ESR2CYP3A4 | |
| SCHEMBL8768162 | 0.82 | AKR1C3 (0.30) | AKR1C3 | |
| SCHEMBL9169898 | 0.82 | — | — | |
| SCHEMBL5891679 | 0.82 | AR (0.45) | PGRNR3C1ARCYP3A4 | |
| SCHEMBL6865376 | 0.82 | AR (0.45) | PGRNR3C1ARCYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6316432-B1 | ANTIESTROGENS AND ANTIFERTILITY AGENTS | SCHERING AKTIENGESELLSCHAFT (DE) | 2001-11-13 | — | — | US | disclosed |