Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 20/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL10159696 | 0.93 | ROCK2 (0.64) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL307104 | 0.89 | ROCK2 (0.64) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL10022648 | 0.82 | ROCK2 (0.82) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL14135086 | 0.81 | ROCK2 (0.71) | ROCK2CYP3A4 | |
| SCHEMBL306811 | 0.80 | ROCK2 (0.88) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL10195863 | 0.80 | ROCK2 (0.77) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL10053628 | 0.79 | ROCK2 (0.65) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL306850 | 0.78 | ROCK2 (0.84) | ROCK2CYP3A4ROCK1 | |
| SCHEMBL10198534 | 0.77 | ROCK2 (0.68) | ROCK2CYP3A4 | |
| SCHEMBL10066607 | 0.77 | ROCK2 (0.84) | ROCK2CYP3A4ROCK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8093266-B2 | Rho kinase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-10 | — | — | US | claimed |
| US-8093266-B2 | Rho kinase inhibitors | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-10 | — | — | US | disclosed |
| WO-2008086047-A1 | RHO KINASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-07-17 | — | — | WO | disclosed |