Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90B1 | P14625 | 5/20 | 0.38 |
| ▸ | TRAP1 | Q12931 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.35 |
| ▸ | ABL1 | P00519 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 2/20 | 0.35 |
| ▸ | HCK | P08631 | 2/20 | 0.35 |
| ▸ | SRC | P12931 | 2/20 | 0.35 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.35 |
| ▸ | MTOR | P42345 | 2/20 | 0.35 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.35 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.35 |
| ▸ | PRKDC | P78527 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL6650314 | 0.93 | HSP90AA1 (0.36) | HSP90B1TRAP1CYP2D6TSHRCYP2C19 | |
| SCHEMBL6651569 | 0.84 | KMT2A (0.47) | HSP90B1CYP2D6TSHRCYP2C19HIF1A | |
| SCHEMBL6648613 | 0.84 | KCNH2 (0.39) | HSP90B1CYP2D6TSHRCYP2C19HIF1A | |
| SCHEMBL5705441 | 0.84 | HSP90AA1 (0.36) | HSP90B1CYP2D6TSHRCYP2C19HIF1A | |
| SCHEMBL6654254 | 0.78 | TRPM5 (0.37) | CYP2D6TSHRCYP2C19HIF1AKMT2A | |
| SCHEMBL6651515 | 0.75 | KMT2A (0.48) | CYP2D6TSHRCYP2C19HIF1AKMT2A | |
| SCHEMBL16061241 | 0.72 | CSNK2A1 (0.42) | KMT2AKCNH2ALDH1A1CSNK2A1 | |
| SCHEMBL6648269 | 0.71 | KMT2A (0.46) | CYP2D6TSHRCYP2C19HIF1AKMT2A | |
| SCHEMBL4909447 | 0.69 | MAPT (0.46) | HSP90B1TRAP1CYP2D6CYP2C19KMT2A | |
| SCHEMBL586216 | 0.68 | MEN1 (0.42) | TSHRCYP2C19HIF1AKMT2AHSP90AA1 |
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-1103243-B1 | UTILIZATION OF ARYL(OR HETEROARYL)AZOLYLCARBINOL DERIVATIVES FOR THE TREATMENT OF TROUBLES MEDIATED BY AN EXCESS OF SUBSTANCE P | ESTEVE LABOR DR (ES) | 2004-01-07 | — | — | EP | claimed |