Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4A | P27815 | 18/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 18/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 18/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 18/20 | 0.48 |
| ▸ | PDE5A | O76074 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6220726 | 0.92 | PDE4A (0.46) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL6222612 | 0.86 | PDE4A (0.49) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL6220689 | 0.85 | PDE4A (0.49) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL6220337 | 0.84 | PDE4A (0.51) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL6219914 | 0.79 | CYP2C9 (0.44) | PDE4APDE4BPDE4CPDE4DCYP2C9 | |
| SCHEMBL5776678 | 0.79 | PDE4A (0.55) | PDE4APDE4BPDE4CPDE4DCYP2C9 | |
| SCHEMBL5775465 | 0.79 | SLC40A1 (0.48) | PDE4APDE4BPDE4CPDE4DCYP2C9 | |
| SCHEMBL6633973 | 0.78 | PDE4A (0.53) | PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL6221499 | 0.78 | PDE4A (0.47) | PDE4APDE4BPDE4CPDE4DPDE5A | |
| SCHEMBL5779469 | 0.77 | PDE4A (0.51) | PDE4APDE4BPDE4CPDE4DCYP2C9 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |