Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 7/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.52 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.52 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 6/20 | 0.44 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | PGR | P06401 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | FYN | P06241 | 2/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL3314631 | 0.83 | ESR1 (0.61) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL8596721 | 0.83 | ESR1 (0.61) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL641477 | 0.76 | ESR1 (0.80) | ESR1ESR2CYP19A1PTGS2PGR | |
| SCHEMBL585024 | 0.76 | ESR1 (0.55) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL9310985 | 0.76 | ESR1 (0.55) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL14085306 | 0.74 | ESR1 (0.53) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL9275462 | 0.74 | ESR1 (0.53) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL28148537 | 0.74 | ESR1 (0.53) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL1985832 | 0.73 | ESR1 (0.52) | ESR1ESR2CYP19A1ATMPTGS2 | |
| SCHEMBL1985833 | 0.73 | ESR1 (0.52) | ESR1ESR2CYP19A1ATMPTGS2 |
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-2844678-A1 | POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY | Bridgestone Corporation (JP) | 2015-03-11 | — | — | EP | disclosed |
| WO-2013166124-A1 | POLYDIENES AND DIENE COPOLYMERS HAVING ORGANOPHOSPHINE FUNCTIONALITY | BRIDGESTONE CORPORATION (JP) | 2013-11-07 | — | — | WO | disclosed |