Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 20/20 | 0.72 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.66 |
| ▸ | PKN2 | Q16513 | 5/20 | 0.66 |
| ▸ | CDC42 | P60953 | 3/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL18011001 | 0.88 | ROCK2 (0.65) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL4005552 | 0.84 | ROCK2 (1.00) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL17182065 | 0.84 | ROCK2 (0.78) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL5090736 | 0.84 | ROCK2 (0.77) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL5090644 | 0.83 | ROCK2 (0.72) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL4005986 | 0.83 | ROCK2 (0.72) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL4001640 | 0.82 | ROCK2 (0.70) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL7300646 | 0.82 | ROCK2 (1.00) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL5087610 | 0.81 | ROCK2 (0.81) | ROCK2ROCK1PKN2CDC42 | |
| SCHEMBL5089585 | 0.81 | ROCK2 (1.00) | ROCK2ROCK1PKN2CDC42 |
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 |
|---|---|---|---|---|---|---|---|
| US-8809326-B2 | Isoquinolinone Rho kinase inhibitors | AERIE PHARMACEUTICALS, INC. (US) | 2014-08-19 | — | — | US | disclosed |