Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 19/20 | 0.64 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | TAS2R8 | Q9NYW2 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL28489710 | 0.91 | ROCK2 (0.62) | ROCK2 | |
| SCHEMBL22227667 | 0.90 | ROCK2 (0.65) | ROCK2ROCK1 | |
| SCHEMBL17912897 | 0.88 | ROCK2 (0.63) | ROCK2ROCK1TAS2R8 | |
| SCHEMBL22227641 | 0.88 | ROCK2 (0.65) | ROCK2 | |
| SCHEMBL22227643 | 0.85 | ROCK2 (0.67) | ROCK2ROCK1 | |
| SCHEMBL16915115 | 0.85 | ROCK2 (0.65) | ROCK2 | |
| SCHEMBL28477382 | 0.84 | ROCK2 (0.62) | ROCK2ROCK1 | |
| SCHEMBL16915171 | 0.83 | ROCK2 (0.65) | ROCK2ROCK1 | |
| SCHEMBL22227653 | 0.82 | ROCK2 (0.63) | ROCK2ROCK1 | |
| SCHEMBL22227673 | 0.82 | ROCK2 (0.64) | ROCK2ROCK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-107406426-B | Cyclic ureas as ROCK inhibitors | 百时美施贵宝公司 | 2020-11-20 | — | — | CN | claimed |