Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 18/20 | 0.77 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.54 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.54 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.46 |
| ▸ | CDK4 | P11802 | 1/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.44 |
| ▸ | CCND1 | P24385 | 1/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | CCND3 | P30281 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3386111 | 0.89 | ROCK2 (0.76) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3384062 | 0.88 | ROCK2 (0.74) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3387396 | 0.87 | ROCK2 (1.00) | ROCK2MAPK10ROCK1CDC42BPACD274 | |
| SCHEMBL3389691 | 0.87 | ROCK2 (0.61) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3388681 | 0.86 | ROCK2 (0.74) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3385585 | 0.85 | ROCK2 (0.60) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3388843 | 0.85 | ROCK2 (0.60) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3385498 | 0.85 | ROCK2 (0.59) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3384073 | 0.85 | ROCK2 (0.59) | ROCK2MAPK10ROCK1CDC42BPA | |
| SCHEMBL3385572 | 0.85 | ROCK2 (0.61) | ROCK2MAPK10ROCK1CDC42BPA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010056758-A1 | QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-05-20 | — | — | WO | disclosed |
| WO-2010056758-A1 | QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-05-20 | — | — | WO | disclosed |