Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 6/20 | 0.40 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.35 |
| ▸ | KDM4A | O75164 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.35 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.35 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 2/20 | 0.34 |
| ▸ | TDO2 | P48775 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM2B | Q8NHM5 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.34 |
| ▸ | GABRD | O14764 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.34 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.34 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL25530633 | 0.91 | ROCK2 (0.45) | ROCK2ROCK1IDO1 | |
| SCHEMBL25530636 | 0.85 | ROCK2 (0.43) | ROCK2ROCK1BRD4 | |
| SCHEMBL25530811 | 0.81 | BRD4 (0.49) | ROCK2ROCK1BRD4 | |
| SCHEMBL25528651 | 0.81 | ROCK2 (0.38) | ROCK2ROCK1KMT2ABRD4 | |
| SCHEMBL25530887 | 0.80 | KMT2A (0.39) | ROCK2ROCK1KMT2AKDM4CKDM4A | |
| SCHEMBL25528328 | 0.80 | BRD4 (0.43) | ROCK2ROCK1BRD4 | |
| SCHEMBL25529501 | 0.79 | ROCK1 (0.47) | ROCK2ROCK1KMT2AKDM4CKDM4A | |
| SCHEMBL25528332 | 0.79 | ROCK2 (0.38) | ROCK2ROCK1PRKAG1PRKAA2PRKAB1 | |
| SCHEMBL25528333 | 0.78 | ROCK2 (0.39) | ROCK2ROCK1BRD4 | |
| SCHEMBL25529691 | 0.77 | ROCK2 (0.40) | ROCK2ROCK1IDO1TDO2BRD4 |
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 |