Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 17/20 | 0.74 |
| ▸ | PDE4A | P27815 | 6/20 | 0.62 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.62 |
| ▸ | PDE4C | Q08493 | 6/20 | 0.62 |
| ▸ | PDE4D | Q08499 | 6/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL5256870 | 0.89 | CYP2C9 (0.77) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5256109 | 0.85 | CYP2C9 (1.00) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5257763 | 0.83 | CYP2C9 (0.75) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5257354 | 0.83 | CYP2C9 (1.00) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5256304 | 0.82 | CYP2C9 (0.85) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5259372 | 0.82 | CYP2C9 (0.77) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4206673 | 0.82 | CYP2C9 (0.80) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5258655 | 0.82 | CYP2C9 (0.71) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5257728 | 0.82 | CYP2C9 (0.73) | CYP2C9PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL5255251 | 0.81 | CYP2C9 (1.00) | 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 4 patents. 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 | disclosed |
| US-7153968-B2 | 8-(biaryl)quinoline PDE4 inhibitors | MERCK FROSST CANADA, LTD. (CA) | 2006-12-26 | — | — | US | disclosed |
| EP-1517895-A1 | 8-(BIARYL) QUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA INC. (CA) | 2005-03-30 | — | — | EP | disclosed |
| WO-2004000814-A1 | 8-(BIARYL) QUINOLINE PDE4 INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2003-12-31 | — | — | WO | disclosed |