Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 18/20 | 0.76 |
| ▸ | ROCK1 | Q13464 | 10/20 | 0.57 |
| ▸ | CDC42BPA | Q5VT25 | 4/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | PRKACA | P17612 | 1/20 | 0.51 |
| ▸ | PRKACG | P22612 | 1/20 | 0.51 |
| ▸ | PRKACB | P22694 | 1/20 | 0.51 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.50 |
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 | 0.92 | ROCK2 (0.65) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL13390999 | 0.91 | ROCK2 (0.62) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3244989 | 0.91 | ROCK2 (0.64) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3250291 | 0.89 | ROCK2 (0.74) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3244210 | 0.86 | ROCK2 (0.81) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3244682 | 0.86 | ROCK2 (0.57) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3236015 | 0.86 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3255470 | 0.86 | ROCK2 (0.74) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3249062 | 0.85 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL13391300 | 0.85 | ROCK2 (0.59) | 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 | disclosed |
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | disclosed |