Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 17/20 | 0.62 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.56 |
| ▸ | CDC42BPA | Q5VT25 | 3/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | PRKACA | P17612 | 1/20 | 0.49 |
| ▸ | PRKACG | P22612 | 1/20 | 0.49 |
| ▸ | PRKACB | P22694 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL3239731 | 0.96 | ROCK2 (0.60) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3253611 | 0.94 | ROCK2 (0.61) | ROCK2ROCK1CDC42BPACYP2C9NPC1 | |
| SCHEMBL3255470 | 0.91 | ROCK2 (0.74) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3248596 | 0.90 | ROCK2 (0.53) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL3252549 | 0.90 | ROCK2 (0.56) | ROCK2ROCK1CDC42BPACYP2C9NPC1 | |
| SCHEMBL3250079 | 0.89 | ROCK2 (0.55) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3240774 | 0.89 | ROCK2 (0.62) | ROCK2ROCK1CDC42BPA | |
| SCHEMBL3247376 | 0.89 | ROCK2 (0.64) | ROCK2ROCK1CDC42BPACYP2C9CYP3A4 | |
| SCHEMBL3252331 | 0.87 | ROCK2 (0.53) | ROCK2ROCK1CDC42BPACYP2C9NPC1 | |
| SCHEMBL3244882 | 0.87 | ROCK2 (0.55) | 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 |