Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 8/20 | 0.36 |
| ▸ | PGR | P06401 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 3/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | PDE2A | O00408 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7967445 | 0.87 | TRPV4 (0.37) | KDM1ASCN9AMEN1CYP1A2CYP2C9 | |
| SCHEMBL8440236 | 0.86 | GPBAR1 (0.33) | SCN9AMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL4625485 | 0.85 | BCAT2 (0.44) | ARSCN9A | |
| SCHEMBL5398257 | 0.84 | CYP1A2 (0.35) | HSP90AA1HSP90AB1PDE2APDE10AMEN1 | |
| SCHEMBL7164579 | 0.83 | MEN1 (0.33) | ARMEN1CYP1A2CYP2C9CYP2C19 | |
| SCHEMBL8566825 | 0.82 | GAA (0.36) | EGFRSCN9APDE2APDE10AMEN1 | |
| SCHEMBL8566841 | 0.77 | ALDH1A1 (0.35) | MEN1CYP1A2CYP2C19KMT2A | |
| SCHEMBL6911424 | 0.75 | MEN1 (0.33) | MEN1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL6912537 | 0.75 | MEN1 (0.33) | MEN1CYP1A2CYP2C9CYP2C19KMT2A | |
| SCHEMBL8569813 | 0.75 | ALDH1A1 (0.35) | MEN1CYP1A2CYP2C19KMT2A |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0897383-A1 | 3-CYANOARYL PYRAZOLES AND THEIR USE AS HERBICIDES | BAYER AG (DE) | 1999-02-24 | — | — | EP | disclosed |
| WO-1997040018-A1 | 3-CYANOARYL PYRAZOLES AND THEIR USE AS HERBICIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-10-30 | — | — | WO | disclosed |