Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 10/20 | 1.00 |
| ▸ | ROCK1 | Q13464 | 10/20 | 1.00 |
| ▸ | CDC42BPB | Q9Y5S2 | 10/20 | 1.00 |
| ▸ | CDC42BPA | Q5VT25 | 6/20 | 1.00 |
| ▸ | LRRK2 | Q5S007 | 10/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL20744117 | 1.00 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL16190651 | 0.80 | LRRK2 (0.67) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL29399871 | 0.78 | ROCK2 (0.63) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL30674338 | 0.77 | LRRK2 (0.66) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL26930286 | 0.77 | LRRK2 (0.66) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL30543157 | 0.77 | LRRK2 (1.00) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL2105745 | 0.77 | LRRK2 (1.00) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL3561097 | 0.77 | LRRK2 (0.66) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL20758415 | 0.76 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 | |
| SCHEMBL29869471 | 0.76 | ROCK2 (1.00) | ROCK2ROCK1CDC42BPBCDC42BPALRRK2 |
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-111278840-B | Pyrrolo [2,3-B ] pyridine compounds and their use for the treatment of cancer | 癌症研究科技有限公司 | 2023-11-17 | — | — | CN | disclosed |