Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 17/20 | 0.56 |
| ▸ | CDC42BPA | Q5VT25 | 5/20 | 0.56 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.56 |
| ▸ | AKT1 | P31749 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3252386 | 0.95 | ROCK2 (0.57) | ROCK2CDC42BPAROCK1CYP2C9 | |
| SCHEMBL3248676 | 0.88 | ROCK2 (0.58) | ROCK2CDC42BPAROCK1CYP2C9 | |
| SCHEMBL3247609 | 0.88 | ROCK2 (0.60) | ROCK2CDC42BPAROCK1 | |
| SCHEMBL3244488 | 0.88 | ROCK2 (0.57) | ROCK2CDC42BPAROCK1CYP2C9 | |
| SCHEMBL3247404 | 0.86 | ROCK2 (0.74) | ROCK2CDC42BPAROCK1 | |
| SCHEMBL3124497 | 0.83 | ROCK2 (0.62) | ROCK2CDC42BPAROCK1 | |
| SCHEMBL3248264 | 0.81 | ROCK2 (0.62) | ROCK2CDC42BPAROCK1CYP2C9 | |
| SCHEMBL3253611 | 0.81 | ROCK2 (0.61) | ROCK2CDC42BPAROCK1CYP2C9 | |
| SCHEMBL3246515 | 0.80 | ROCK2 (0.57) | ROCK2CDC42BPAROCK1 | |
| SCHEMBL3252549 | 0.80 | ROCK2 (0.56) | ROCK2CDC42BPAROCK1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |
| WO-2010036316-A1 | UREA AND CARBAMATE COMPOUNDS AND ANALOGS AS KINASE INHIBITORS | FENG YANGBO (US) | 2010-04-01 | — | — | WO | disclosed |