Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP17A1 | P05093 | 12/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.40 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.40 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.40 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.40 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.40 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.40 |
| ▸ | MAP4K4 | O95819 | 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 | |
|---|---|---|---|---|
| SCHEMBL5688634 | 0.93 | CYP17A1 (0.52) | CYP17A1CYP3A4MAP4K4 | |
| SCHEMBL5688564 | 0.90 | CYP17A1 (0.66) | CYP17A1CYP3A4 | |
| SCHEMBL7563594 | 0.90 | CYP17A1 (0.66) | CYP17A1CYP3A4 | |
| SCHEMBL29478298 | 0.90 | CYP17A1 (0.66) | CYP17A1CYP3A4 | |
| SCHEMBL22284856 | 0.88 | CYP17A1 (0.67) | CYP17A1CYP3A4 | |
| SCHEMBL5688287 | 0.82 | CYP17A1 (0.56) | CYP17A1CYP3A4 | |
| SCHEMBL7537714 | 0.82 | CYP17A1 (0.51) | CYP17A1CYP3A4 | |
| SCHEMBL5688459 | 0.82 | CYP17A1 (0.47) | CYP17A1CYP3A4 | |
| SCHEMBL5688568 | 0.82 | CYP17A1 (0.53) | CYP17A1CYP3A4MAP4K4 | |
| SCHEMBL5688304 | 0.80 | CYP17A1 (0.68) | CYP17A1CYP3A4 |
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-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 |