Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 7/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 7/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | PRKAG1 | P54619 | 2/20 | 0.39 |
| ▸ | PRKAA2 | P54646 | 2/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 2/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.39 |
| ▸ | TDO2 | P48775 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | KDM4A | O75164 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.37 |
| ▸ | PDE4A | P27815 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.36 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25530887 | 0.90 | KMT2A (0.39) | ROCK1ROCK2KMT2APRKAG1PRKAA2 | |
| SCHEMBL25529500 | 0.90 | ROCK2 (0.59) | ROCK1ROCK2IDO1BRD4 | |
| SCHEMBL25528471 | 0.87 | ROCK2 (0.44) | ROCK1ROCK2IDO1TDO2BRD4 | |
| SCHEMBL25530907 | 0.84 | IRAK4 (0.43) | ROCK1ROCK2BRD4 | |
| SCHEMBL25528176 | 0.84 | ROCK2 (0.57) | ROCK1ROCK2 | |
| SCHEMBL25528179 | 0.84 | ROCK2 (0.57) | ROCK1ROCK2 | |
| SCHEMBL25528185 | 0.84 | ROCK2 (0.43) | ROCK1ROCK2 | |
| SCHEMBL25529068 | 0.84 | ROCK2 (0.43) | ROCK1ROCK2 | |
| SCHEMBL25530880 | 0.80 | ROCK1 (0.48) | ROCK1ROCK2KMT2AIDO1 | |
| SCHEMBL25530634 | 0.79 | ROCK2 (0.40) | ROCK1ROCK2KMT2APRKAG1PRKAA2 |
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-2023093787-A1 | BENZODIAZEPINE COMPOUND AND APPLICATION THEREOF AS RHO KINASE INHIBITOR | 成都奥睿药业有限公司 | 2023-06-01 | — | — | WO | disclosed |