Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 15/20 | 0.62 |
| ▸ | ROCK1 | Q13464 | 9/20 | 0.62 |
| ▸ | PRKACA | P17612 | 5/20 | 0.59 |
| ▸ | PRKACG | P22612 | 5/20 | 0.59 |
| ▸ | PRKACB | P22694 | 5/20 | 0.59 |
| ▸ | CLK1 | P49759 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL1648098 | 0.92 | ROCK2 (0.55) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1649817 | 0.88 | ROCK2 (0.54) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL23384852 | 0.88 | ROCK2 (0.50) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1649577 | 0.87 | CLK1 (0.75) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1648756 | 0.87 | AURKA (0.63) | ROCK2ROCK1PRKACACLK1 | |
| SCHEMBL1649578 | 0.84 | ROCK2 (0.61) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL19723671 | 0.84 | CLK1 (0.61) | ROCK2ROCK1PRKACACLK1 | |
| SCHEMBL1648234 | 0.83 | ROCK2 (0.65) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1649632 | 0.81 | ROCK2 (0.61) | ROCK2ROCK1PRKACAPRKACGPRKACB | |
| SCHEMBL1648102 | 0.81 | CLK1 (0.52) | ROCK2ROCK1PRKACAPRKACGPRKACB |
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-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |
| WO-2011050245-A1 | BICYCLIC HETEROARYLS AS KINASE INHIBITORS | FENG YANGBO (US) | 2011-04-28 | — | — | WO | disclosed |