Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 7/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.46 |
| ▸ | HTR7 | P34969 | 3/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CNR1 | P21554 | 1/20 | 0.33 |
| ▸ | CTSA | P10619 | 1/20 | 0.33 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.32 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.31 |
| ▸ | FEN1 | P39748 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5690534 | 0.87 | CYP17A1 (0.60) | CYP17A1CYP3A4PTPN1PTPN5 | |
| SCHEMBL5688968 | 0.85 | PTPN5 (0.46) | CYP17A1CYP3A4HTR7CTSAPTPN1 | |
| SCHEMBL5688787 | 0.84 | CYP3A4 (0.42) | CYP17A1CYP3A4PTPN5 | |
| SCHEMBL5688356 | 0.83 | CYP17A1 (0.50) | CYP17A1CYP3A4PTPN5 | |
| SCHEMBL5688690 | 0.81 | CYP17A1 (0.51) | CYP17A1CYP3A4HTR7HTR1ACNR1 | |
| SCHEMBL5688702 | 0.81 | CYP17A1 (0.53) | CYP17A1CYP3A4 | |
| SCHEMBL5688934 | 0.81 | CYP17A1 (0.52) | CYP17A1CYP3A4PTPN1 | |
| SCHEMBL5688337 | 0.81 | CYP17A1 (0.47) | CYP17A1CYP3A4 | |
| SCHEMBL5688390 | 0.81 | CYP17A1 (0.47) | CYP17A1CYP3A4CNR1 | |
| SCHEMBL5688515 | 0.80 | CYP17A1 (0.63) | CYP17A1CYP3A4PTPN5 |
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 |