Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 5/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.34 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | ESRRA | P11474 | 1/20 | 0.34 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.34 |
| ▸ | SIRT5 | Q9NXA8 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5854246 | 0.97 | ESR1 (0.33) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5855127 | 0.96 | ESR1 (0.34) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL7589349 | 0.92 | ESR1 (0.34) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL7588501 | 0.92 | ESR1 (0.34) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5856112 | 0.90 | ESR1 (0.32) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5857658 | 0.89 | ESR1 (0.32) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5857292 | 0.89 | ESR1 (0.35) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5856146 | 0.88 | ESR1 (0.35) | ESR1ESR2NR1I2NR3C1PGR | |
| SCHEMBL5854551 | 0.87 | — | — | |
| SCHEMBL5855226 | 0.87 | ESR1 (0.47) | ESR1ESR2NR1I2NR3C1PGR |
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-7074819-B2 | Benzopyran or thiobenzopyran derivatives | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2006-07-11 | — | — | US | disclosed |
| US-6645951-B1 | Antiestrogens for treating breast cancer | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2003-11-11 | — | — | US | disclosed |