Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 15/20 | 1.00 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.65 |
| ▸ | MET | P08581 | 5/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8332879 | 0.93 | ROCK2 (1.00) | ROCK2CYP3A4MET | |
| SCHEMBL8329940 | 0.91 | ROCK2 (0.86) | ROCK2CYP3A4MET | |
| SCHEMBL2879852 | 0.89 | ROCK2 (0.79) | ROCK2CYP3A4MET | |
| SCHEMBL8326576 | 0.88 | ROCK2 (0.78) | ROCK2CYP3A4MET | |
| SCHEMBL8320407 | 0.87 | ROCK2 (0.79) | ROCK2CYP3A4MET | |
| SCHEMBL13288507 | 0.86 | ROCK2 (0.78) | ROCK2CYP3A4MET | |
| SCHEMBL8327167 | 0.86 | ROCK2 (0.78) | ROCK2CYP3A4MET | |
| SCHEMBL8321717 | 0.85 | ROCK2 (0.76) | ROCK2CYP3A4MET | |
| SCHEMBL8323931 | 0.85 | ROCK2 (0.73) | ROCK2CYP3A4MET | |
| SCHEMBL8332861 | 0.84 | ROCK2 (0.75) | ROCK2CYP3A4MET |
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-7737153-B2 | Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-15 | — | — | US | disclosed |
| US-7737153-B2 | Heteroaryloxy-substituted phenylaminopyrimidines as rho-kinase inhibitors | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2010-06-15 | — | — | US | disclosed |
| WO-2004039796-A1 | HETEROARYLOXY-SUBSTITUTED PHENYLAMINOPYRIMIDINES AS RHO-KINASE INHIBITORS | BAYER HEALTHCARE AG (DE) | 2004-05-13 | — | — | WO | disclosed |