Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 6/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 10/20 | 0.41 |
| ▸ | CASR | P41180 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 1/20 | 0.35 |
| ▸ | MAP3K11 | Q16584 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | P2RX2 | Q9UBL9 | 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 | |
|---|---|---|---|---|
| SCHEMBL5690835 | 0.89 | CYP3A4 (0.41) | CYP17A1CYP3A4CASRCYP2C9CYP2C19 | |
| SCHEMBL5688562 | 0.88 | BACE1 (0.39) | CYP17A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5689182 | 0.86 | CYP17A1 (0.44) | CYP17A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5691092 | 0.84 | CYP17A1 (0.42) | CYP17A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL5689007 | 0.83 | CYP17A1 (0.58) | CYP17A1CYP3A4 | |
| SCHEMBL5688327 | 0.81 | CYP17A1 (0.63) | CYP17A1CYP3A4CYP2C9CYP2C19KIT | |
| SCHEMBL5689213 | 0.81 | CYP17A1 (0.48) | CYP17A1CYP3A4KIT | |
| SCHEMBL5688423 | 0.80 | CYP17A1 (0.46) | CYP17A1CYP3A4 | |
| SCHEMBL5689388 | 0.80 | CYP17A1 (0.39) | CYP17A1CYP3A4 | |
| SCHEMBL5688968 | 0.80 | PTPN5 (0.46) | CYP17A1CYP3A4CYP2C9CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1227086-B1 | 1-SUBSTITUTED PHENYL-1-(1H-IMIDAZOL-4-YL) ALCOHOLS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | TAKEDA PHARMACEUTICAL (JP) | 2006-03-29 | — | — | EP | disclosed |
| US-6518257-B1 | 1-substituted phenyl-1-(1h-imidazol-4-yl) alcohols, process for producing the same and use thereof | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 2003-02-11 | — | — | US | disclosed |
| EP-1227086-A1 | 1-SUBSTITUTED PHENYL-1-(1H-IMIDAZOL-4-YL) ALCOHOLS, PROCESS FOR PRODUCING THE SAME AND USE THEREOF | Takeda Chemical Industries, Ltd. (JP) | 2002-07-31 | — | — | EP | disclosed |