Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 5/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.39 |
| ▸ | KDM5A | P29375 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.38 |
| ▸ | KIF11 | P52732 | 1/20 | 0.38 |
| ▸ | FYN | P06241 | 1/20 | 0.37 |
| ▸ | ACSS2 | Q9NR19 | 2/20 | 0.37 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.37 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.37 |
| ▸ | SIRT2 | Q8IXJ6 | 4/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.36 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5688583 | 0.94 | CYP17A1 (0.56) | CYP17A1CYP3A4CDK8KDM5AKDM4C | |
| SCHEMBL4031099 | 0.86 | CYP17A1 (0.52) | CYP17A1CYP3A4ACSS2SIRT2 | |
| SCHEMBL5691363 | 0.86 | CYP3A4 (0.46) | CYP17A1CYP3A4ACSS2SIRT2 | |
| SCHEMBL5688704 | 0.85 | CYP17A1 (0.44) | CYP17A1CYP3A4CDK8KDM5AKDM4C | |
| SCHEMBL5688802 | 0.84 | CYP17A1 (0.45) | CYP17A1CYP3A4CDK8ACSS2SIRT2 | |
| SCHEMBL5688616 | 0.84 | CYP17A1 (0.43) | CYP17A1CYP3A4CDK8FYNSIRT2 | |
| SCHEMBL5690727 | 0.83 | CYP17A1 (0.47) | CYP17A1CYP3A4FYN | |
| SCHEMBL5688382 | 0.83 | CYP17A1 (0.45) | CYP17A1CYP3A4CDK8KDM5AKDM4C | |
| SCHEMBL5688555 | 0.83 | CYP17A1 (0.48) | CYP17A1CYP3A4PIK3CGFGFR1FGFR3 | |
| SCHEMBL5688655 | 0.83 | CYP17A1 (0.44) | CYP17A1CYP3A4ACSS2 |
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 |