Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 19/20 | 0.53 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.53 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5243553 | 1.00 | PDE5A (0.53) | PDE5AKCNH2ROCK2ROCK1 | |
| SCHEMBL12768633 | 0.92 | PDE5A (0.62) | PDE5AKCNH2 | |
| SCHEMBL5243432 | 0.92 | PDE5A (0.65) | PDE5AKCNH2ROCK2ROCK1 | |
| SCHEMBL5246960 | 0.90 | PDE5A (0.56) | PDE5AKCNH2 | |
| SCHEMBL5252664 | 0.90 | PDE5A (0.56) | PDE5AKCNH2 | |
| SCHEMBL5243900 | 0.88 | PDE5A (0.57) | PDE5AKCNH2 | |
| SCHEMBL5247522 | 0.88 | PDE5A (0.57) | PDE5AKCNH2 | |
| SCHEMBL5244306 | 0.88 | PDE5A (0.60) | PDE5AKCNH2 | |
| SCHEMBL5247530 | 0.85 | PDE5A (0.72) | PDE5AKCNH2 | |
| SCHEMBL5245905 | 0.85 | PDE5A (0.72) | PDE5AKCNH2 |
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-1809632-A2 | PYRAZOLO[4,3-D]PYRIMIDINE DERIVATIVES USEFUL AS PDE-5 INHIBITORS | Pharmacia & Upjohn Company LLC (US) | 2007-07-25 | — | — | EP | disclosed |
| WO-2006046135-A2 | PYRAZOLO[4,3-D] PYRIMIDINE DERIVATIVES USEFUL AS PDE-5 INHIBITORS | PHARMACIA & UPJOHN COMPANY LLC (US) | 2006-05-04 | — | — | WO | disclosed |