Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CACNA1G | O43497 | 4/20 | 0.32 |
| ▸ | BRD4 | O60885 | 3/20 | 0.32 |
| ▸ | WNT1 | P04628 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | CLK3 | P49761 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.32 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.32 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25528830 | 0.90 | HPGD (0.33) | HPGD | |
| SCHEMBL25528834 | 0.87 | HTR7 (0.33) | POLBLMNAALDH1A1KDM4ECACNA1G | |
| SCHEMBL25528466 | 0.86 | ROCK2 (0.37) | ALDH1A1CACNA1GBRD4WNT1CLK2 | |
| SCHEMBL25528343 | 0.86 | PARP1 (0.43) | BRD4GSK3BROCK2ROCK1MAPK14 | |
| SCHEMBL25528346 | 0.80 | ROCK2 (0.36) | KDM4ECACNA1GBRD4ROCK2ROCK1 | |
| SCHEMBL25528467 | 0.78 | HTR7 (0.34) | — | |
| SCHEMBL25528468 | 0.77 | CACNA1H (0.36) | LMNAMAPK14 | |
| SCHEMBL25529692 | 0.75 | ROCK2 (0.52) | ROCK2ROCK1 | |
| SCHEMBL25528771 | 0.75 | ROCK2 (0.42) | BRD4ROCK2ROCK1MAPK14 | |
| SCHEMBL25528328 | 0.73 | BRD4 (0.43) | BRD4ROCK2ROCK1 |
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 |