Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.50 |
| ▸ | PPARA | Q07869 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | RHEB | Q15382 | 1/20 | 0.40 |
| ▸ | PPARG | P37231 | 3/20 | 0.40 |
| ▸ | FABP2 | P12104 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | ESRRA | P11474 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.38 |
| ▸ | HTR2A | P28223 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22406876 | 0.87 | AR (0.48) | ARTLR8MAPK14ESRRAHTT | |
| SCHEMBL22439742 | 0.85 | PPARA (0.45) | ARPPARAMEN1CYP1A2CYP3A4 | |
| SCHEMBL29741722 | 0.84 | AR (0.56) | ARCYP1A2CYP2C19RHEBMAPK14 | |
| SCHEMBL21340542 | 0.84 | AR (0.56) | ARCYP1A2CYP2C19RHEBMAPK14 | |
| SCHEMBL22439727 | 0.82 | PPARA (0.45) | ARPPARAMEN1CYP1A2CYP3A4 | |
| SCHEMBL29446012 | 0.80 | AR (0.51) | ARPPARACYP1A2CYP3A4MAPK14 | |
| SCHEMBL21340544 | 0.80 | AR (0.51) | ARPPARACYP1A2CYP2C19RHEB | |
| SCHEMBL29093106 | 0.79 | AR (0.56) | ARPPARAMEN1KMT2ARHEB | |
| SCHEMBL10426246 | 0.76 | KMT2A (0.54) | PPARAMEN1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL14645660 | 0.76 | AR (0.54) | ARMEN1MAPTKMT2ATLR8 |
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-3712135-A1 | AZOLE DERIVATIVE, INTERMEDIATE COMPOUND, METHOD FOR PRODUCING AZOLE DERIVATIVE, AGENT FOR AGRICULTURAL AND HORTICULTURAL USE, AND MATERIAL PROTECTION AGENT FOR INDUSTRIAL USE | Kureha Corporation (JP) | 2020-09-23 | — | — | EP | disclosed |