Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL10341459 | 0.89 | — | — | |
| SCHEMBL6562400 | 0.84 | ESR2 (0.50) | ESR1ESR2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL5461 | 0.81 | — | — | |
| SCHEMBL2936955 | 0.81 | ESR2 (0.46) | ESR1ESR2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL881445 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL20579190 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL8055914 | 0.78 | — | — | |
| SCHEMBL6564146 | 0.78 | ESR1 (0.45) | ESR1ESR2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL1895624 | 0.76 | ESR2 (0.45) | ESR1ESR2CYP3A4CYP2C9CYP2D6 | |
| SCHEMBL4890514 | 0.75 | ESR1 (0.43) | ESR1ESR2CYP3A4CYP2C9CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3287453-A1 | IMIDAZOLE COMPOUND | Medshine Discovery Inc. (CN) | 2018-02-28 | — | — | EP | disclosed |