Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 14/20 | 0.57 |
| ▸ | PDE4A | P27815 | 7/20 | 0.49 |
| ▸ | PDE4B | Q07343 | 7/20 | 0.49 |
| ▸ | PDE4C | Q08493 | 7/20 | 0.49 |
| ▸ | PDE4D | Q08499 | 7/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5257226 | 0.86 | CYP2C9 (0.53) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5261774 | 0.85 | CYP2C9 (0.57) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5259822 | 0.85 | CYP2C9 (0.52) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5256934 | 0.85 | CYP2C9 (0.52) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5259110 | 0.85 | CYP2C9 (0.69) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5258650 | 0.84 | CYP2C9 (0.70) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5260138 | 0.84 | CYP2C9 (0.69) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5257156 | 0.83 | CYP2C9 (0.77) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5257729 | 0.83 | CYP2C9 (0.69) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5260615 | 0.83 | CYP2C9 (0.53) | CYP2C9PDE4APDE4BPDE4CPDE4D |
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-1517895-B1 | 8-(BIARYL) QUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2007-03-14 | — | — | EP | claimed |