Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 19/20 | 0.64 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.50 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3252693 | 0.95 | ROCK2 (0.65) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3124355 | 0.91 | ROCK2 (0.76) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL13390999 | 0.89 | ROCK2 (0.62) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3249875 | 0.87 | ROCK2 (0.67) | ROCK2ROCK1 | |
| SCHEMBL3241441 | 0.85 | ROCK2 (0.85) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3245577 | 0.84 | ROCK2 (0.76) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3247086 | 0.84 | ROCK2 (0.73) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3246339 | 0.83 | ROCK2 (0.72) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3249281 | 0.82 | ROCK2 (0.55) | ROCK2ROCK1CYP2C9CDC42BPACYP3A4 | |
| SCHEMBL3121519 | 0.82 | ROCK2 (0.69) | ROCK2ROCK1 |
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-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | claimed |