Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 19/20 | 1.00 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.69 |
| ▸ | CDC42BPA | Q5VT25 | 4/20 | 0.69 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.64 |
| ▸ | PRKACA | P17612 | 1/20 | 0.55 |
| ▸ | PRKACG | P22612 | 1/20 | 0.55 |
| ▸ | PRKACB | P22694 | 1/20 | 0.55 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL3255831 | 0.92 | ROCK2 (0.86) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3249062 | 0.92 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3268937 | 0.91 | ROCK2 (0.83) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3244674 | 0.89 | ROCK2 (0.81) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3249040 | 0.87 | ROCK2 (0.83) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3244210 | 0.86 | ROCK2 (0.81) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3124355 | 0.86 | ROCK2 (0.76) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3251910 | 0.86 | ROCK2 (0.76) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3241457 | 0.86 | ROCK2 (0.85) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3245625 | 0.85 | ROCK2 (0.88) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 |
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 2 patents. 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 |
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | disclosed |