Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK1 | Q13464 | 10/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.42 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | LNPEP | Q9UIQ6 | 5/20 | 0.36 |
| ▸ | IKBKB | O14920 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL1705330 | 0.82 | ROCK1 (0.51) | ROCK1ROCK2KCNH2LNPEPIKBKB | |
| SCHEMBL1204561 | 0.79 | ROCK1 (0.74) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL1204558 | 0.79 | ROCK1 (0.74) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL3113476 | 0.79 | ROCK1 (0.74) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL2337345 | 0.78 | ROCK1 (0.54) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL2337348 | 0.78 | ROCK1 (0.54) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL12211290 | 0.78 | ROCK1 (0.54) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL13757491 | 0.73 | ROCK1 (0.51) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL13763659 | 0.72 | ROCK1 (0.53) | ROCK1ROCK2KCNH2IKBKB | |
| SCHEMBL13763597 | 0.71 | ROCK1 (0.54) | ROCK1ROCK2KCNH2PDE3BPDE3A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2125746-B1 | CYCLOALKYLAMINE SUBSTITUTED ISOQUINOLINE DERIVATIVES | SANOFI SA (FR) | 2012-04-18 | — | — | EP | claimed |