Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 19/20 | 0.65 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.54 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL3387505 | 0.86 | ROCK2 (0.70) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL3389083 | 0.80 | ROCK2 (0.79) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL25561784 | 0.79 | ROCK2 (1.00) | ROCK2ROCK1 | |
| SCHEMBL13362724 | 0.78 | ROCK2 (0.70) | ROCK2ROCK1 | |
| SCHEMBL3384100 | 0.78 | ROCK2 (0.58) | ROCK2ROCK1 | |
| SCHEMBL3388887 | 0.78 | ROCK2 (0.70) | ROCK2ROCK1 | |
| SCHEMBL3384556 | 0.77 | ROCK2 (0.75) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL3387979 | 0.77 | ROCK2 (0.74) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL13362764 | 0.76 | ROCK2 (0.69) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL3381886 | 0.76 | ROCK2 (0.59) | ROCK2ROCK1CDC42BPA |
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 |