Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 17/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.44 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.40 |
| ▸ | MELK | Q14680 | 1/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3389696 | 0.83 | ROCK2 (0.69) | ROCK2ROCK1 | |
| SCHEMBL13362724 | 0.81 | ROCK2 (0.70) | ROCK2ROCK1 | |
| SCHEMBL3387505 | 0.81 | ROCK2 (0.70) | ROCK2ROCK1 | |
| SCHEMBL3387474 | 0.81 | ROCK2 (0.42) | ROCK2ERN1ROCK1MELKPLAU | |
| SCHEMBL3384100 | 0.81 | ROCK2 (0.58) | ROCK2ROCK1 | |
| SCHEMBL3388887 | 0.81 | ROCK2 (0.70) | ROCK2ROCK1 | |
| SCHEMBL3387260 | 0.76 | ROCK2 (0.58) | ROCK2ROCK1 | |
| SCHEMBL3389150 | 0.76 | KDM4E (0.35) | ROCK2 | |
| SCHEMBL3384066 | 0.73 | ROCK2 (0.47) | ROCK2ERN1ROCK1 | |
| SCHEMBL13362887 | 0.70 | — | — |
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 1 patent. 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 |