Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSEN1 | P49768 | 1/20 | 0.38 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.38 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.38 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.38 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.38 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.37 |
| ▸ | HTR1A | P08908 | 3/20 | 0.37 |
| ▸ | DRD2 | P14416 | 3/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6648269 | 0.87 | KMT2A (0.46) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL6650687 | 0.79 | KMT2A (0.47) | CYP2D6KMT2ATP53CYP3A4CYP2C19 | |
| SCHEMBL6650633 | 0.78 | ALDH1A1 (0.38) | CYP1A2KMT2ACYP3A4CYP2C19MEN1 | |
| SCHEMBL6654380 | 0.77 | HSP90AA1 (0.55) | CYP1A2CYP2D6KMT2ACYP3A4CYP2C19 | |
| SCHEMBL6649429 | 0.77 | KCNH2 (0.41) | PSEN1PSEN2APH1BNCSTNAPH1A | |
| SCHEMBL6648442 | 0.74 | HRH3 (0.39) | SLC6A4HRH1KCNH2CHRM2CHRM4 | |
| SCHEMBL6651569 | 0.73 | KMT2A (0.47) | CYP2D6KMT2ATP53CYP2C19MEN1 | |
| SCHEMBL5705441 | 0.73 | HSP90AA1 (0.36) | CYP2D6KMT2ACYP3A4CYP2C19MEN1 | |
| SCHEMBL6654159 | 0.73 | TRPM5 (0.40) | CYP1A2CYP2D6KMT2ATP53CYP3A4 | |
| SCHEMBL6654254 | 0.73 | TRPM5 (0.37) | CYP1A2CYP2D6KMT2ATP53CYP3A4 |
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 |