Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 7/20 | 0.37 |
| ▸ | ROCK2 | O75116 | 13/20 | 0.36 |
| ▸ | DHODH | Q02127 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | PDE9A | O76083 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 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 | |
|---|---|---|---|---|
| SCHEMBL22966739 | 0.85 | ROCK1 (0.47) | ROCK1ROCK2 | |
| SCHEMBL21217629 | 0.84 | ROCK1 (0.44) | ROCK1ROCK2 | |
| SCHEMBL24610250 | 0.76 | ROCK2 (0.42) | ROCK1ROCK2 | |
| SCHEMBL24610310 | 0.76 | ROCK2 (0.39) | ROCK1ROCK2DHODH | |
| SCHEMBL22966832 | 0.75 | ROCK1 (0.47) | ROCK1ROCK2 | |
| SCHEMBL24094127 | 0.74 | ACACB (0.43) | ROCK1ROCK2DHODHLRRK2 | |
| SCHEMBL21217624 | 0.74 | ROCK1 (0.44) | ROCK1ROCK2 | |
| SCHEMBL22966750 | 0.71 | ROCK1 (0.54) | ROCK1ROCK2 | |
| SCHEMBL21217821 | 0.71 | ROCK1 (0.60) | ROCK1ROCK2 | |
| SCHEMBL21217792 | 0.71 | ROCK1 (0.47) | ROCK1ROCK2 |
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-2019145729-A9 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | REDX PHARMA PLC (GB) | 2020-07-30 | — | — | WO | disclosed |
| WO-2019145729-A1 | HETEROCYCLYLAMINO-SUBSTITUTED TRIAZOLES AS MODULATORS OF RHO-ASSOCIATED PROTEIN KINASE | REDX PHARMA PLC (GB) | 2019-08-01 | — | — | WO | disclosed |