Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK8 | P49336 | 2/20 | 0.59 |
| ▸ | CCNC | P24863 | 1/20 | 0.59 |
| ▸ | MKNK2 | Q9HBH9 | 7/20 | 0.58 |
| ▸ | MKNK1 | Q9BUB5 | 7/20 | 0.58 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 5/20 | 0.52 |
| ▸ | GSK3B | P49841 | 4/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.52 |
| ▸ | CDK2 | P24941 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.52 |
| ▸ | RPS6KA5 | O75582 | 3/20 | 0.52 |
| ▸ | AKT1 | P31749 | 3/20 | 0.52 |
| ▸ | NEK4 | P51957 | 3/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 3/20 | 0.52 |
| ▸ | PRKG2 | Q13237 | 3/20 | 0.52 |
| ▸ | PRKG1 | Q13976 | 3/20 | 0.52 |
| ▸ | PKN2 | Q16513 | 3/20 | 0.52 |
| ▸ | GSK3A | P49840 | 3/20 | 0.52 |
| ▸ | MAPK13 | O15264 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL15870566 | 0.91 | CDK8 (0.61) | CDK8CCNCMKNK2MKNK1ROCK1 | |
| SCHEMBL15870581 | 0.86 | CDK8 (0.57) | CDK8CCNCROCK1ROCK2GSK3B | |
| SCHEMBL15870530 | 0.84 | CCNC (0.58) | CDK8CCNCMKNK2MKNK1ROCK1 | |
| SCHEMBL15870508 | 0.83 | CCNC (0.64) | CDK8CCNCROCK1ROCK2GSK3B | |
| SCHEMBL15870515 | 0.83 | CCNC (0.64) | CDK8CCNCMKNK2MKNK1ROCK1 | |
| SCHEMBL15870552 | 0.83 | CCNC (0.64) | CDK8CCNCROCK1ROCK2GSK3B | |
| SCHEMBL15870506 | 0.83 | CCNC (0.64) | CDK8CCNCROCK1ROCK2GSK3B | |
| SCHEMBL15870532 | 0.80 | CCNC (0.63) | CDK8CCNCROCK1ROCK2CDK2 | |
| SCHEMBL15870567 | 0.80 | CCNC (0.60) | CDK8CCNCROCK1ROCK2GSK3B | |
| SCHEMBL15870509 | 0.80 | CCNC (0.60) | CDK8CCNCROCK1ROCK2GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014106606-A1 | NOVE PHENYL/PYRIDINE SERIES SUBSTITUED BY HYDROXYETHYLAMINO FOR THE TREATMENT OF CANCER | F. HOFFMANN-LA ROCHE AG (CH) | 2014-07-10 | — | — | WO | disclosed |