Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 13/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.47 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11463740 | 0.88 | CYP19A1 (0.65) | CYP3A4CYP2D6CYP19A1CYP1A2 | |
| SCHEMBL11480311 | 0.87 | CYP19A1 (0.59) | CYP3A4CYP19A1 | |
| SCHEMBL11479532 | 0.78 | CYP19A1 (0.65) | CYP3A4CYP19A1 | |
| SCHEMBL11463544 | 0.78 | CYP3A4 (0.55) | CYP3A4CYP2D6CYP19A1CYP1A2ADRA2C | |
| SCHEMBL11465361 | 0.78 | CYP11B1 (0.47) | CYP3A4CYP19A1 | |
| SCHEMBL9364497 | 0.78 | CYP19A1 (0.69) | CYP3A4CYP2D6CYP19A1CYP1A2ADRA2C | |
| SCHEMBL11475075 | 0.77 | CYP3A4 (0.54) | CYP3A4CYP2D6CYP19A1CYP1A2 | |
| SCHEMBL11362732 | 0.76 | CYP17A1 (0.66) | CYP3A4CYP2D6CYP19A1CYP1A2 | |
| SCHEMBL11432482 | 0.71 | CYP17A1 (0.40) | CYP3A4CYP19A1 | |
| SCHEMBL11479601 | 0.71 | CYP3A4 (0.50) | CYP3A4CYP2D6CYP19A1CYP1A2CRHR1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4238498-A | SKIN DISORDERS | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-09 | — | — | US | disclosed |
| EP-0003796-B1 | SUBSTITUTED DIPHENYLMETHYL-IMIDAZOLES, THEIR PREPARATION AND MEDICAMENTS CONTAINING THEM | BAYER AG (DE) | 1980-10-15 | — | — | EP | disclosed |
| EP-0003796-A1 | Substituted diphenylmethyl-imidazoles, their preparation and medicaments containing them | BAYER AG (DE) | 1979-09-05 | — | — | EP | disclosed |