Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 18/20 | 0.63 |
| ▸ | PDE4A | P27815 | 17/20 | 0.63 |
| ▸ | PDE4B | Q07343 | 17/20 | 0.63 |
| ▸ | PDE4C | Q08493 | 17/20 | 0.63 |
| ▸ | PDE4D | Q08499 | 17/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL5845458 | 0.90 | CYP2C9 (0.49) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4040558 | 0.86 | PDE4A (0.65) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6635038 | 0.84 | CYP2C9 (0.61) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4046348 | 0.84 | CYP2C9 (0.67) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5845455 | 0.84 | PDE4A (0.42) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4039707 | 0.82 | PDE4A (0.68) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4037773 | 0.82 | CYP2C9 (0.62) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6183408 | 0.81 | CYP2C9 (0.82) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4037854 | 0.79 | CYP2C9 (0.61) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL8363167 | 0.79 | PDE4A (0.68) | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1487797-B1 | HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA LTD (CA) | 2009-05-27 | — | — | EP | disclosed |
| EP-1487797-A1 | HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | Merck Frosst Canada & Co. (CA) | 2004-12-22 | — | — | EP | disclosed |
| WO-2003078397-A1 | HETERO-BRIDGE SUBSTITUTED 8-ARYLQUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2003-09-25 | — | — | WO | disclosed |