Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 13/20 | 0.58 |
| ▸ | ESR1 | P03372 | 10/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.58 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | TYR | P14679 | 2/20 | 0.44 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6438534 | 1.00 | ESR2 (0.58) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL19249421 | 0.87 | TYR (0.48) | ESR2CYP3A4CYP2C9CYP2D6TYR | |
| SCHEMBL31545041 | 0.81 | CYP2C9 (0.43) | ESR2ESR1CYP3A4CYP2C9TYR | |
| SCHEMBL7706199 | 0.81 | TYR (0.44) | ESR2ESR1CYP3A4CYP2C9TYR | |
| SCHEMBL6436239 | 0.80 | TYR (0.41) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL6433100 | 0.80 | ESR2 (0.50) | ESR2ESR1CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL6435789 | 0.80 | TYR (0.49) | ESR2ESR1CYP3A4CYP2C9TYR | |
| SCHEMBL6437541 | 0.80 | TYR (0.49) | ESR2ESR1CYP3A4CYP2C9TYR | |
| SCHEMBL6437507 | 0.80 | TYR (0.49) | ESR2ESR1CYP3A4CYP2C9TYR | |
| Hydrochloric Acid SCHEMBL6434905 | 0.80 | TYR (0.43) | ESR2ESR1CYP3A4CYP2C9TYR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1165495-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2002-01-02 | — | — | EP | claimed |
| WO-2000056702-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2000-09-28 | — | — | WO | claimed |
| EP-1165495-B1 | RESORCINOL DERIVATIVES | PFIZER (US) | 2005-04-20 | — | — | EP | disclosed |
| EP-1165495-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2002-01-02 | — | — | EP | disclosed |
| WO-2000056702-A1 | RESORCINOL DERIVATIVES | PFIZER INC. (US) | 2000-09-28 | — | — | WO | disclosed |