Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 18/20 | 0.90 |
| ▸ | GSK3B | P49841 | 5/20 | 0.52 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.52 |
| ▸ | CLK4 | Q9HAZ1 | 5/20 | 0.52 |
| ▸ | RPS6KA5 | O75582 | 4/20 | 0.52 |
| ▸ | AKT1 | P31749 | 4/20 | 0.52 |
| ▸ | NEK4 | P51957 | 4/20 | 0.52 |
| ▸ | PRKCD | Q05655 | 4/20 | 0.52 |
| ▸ | PRKG2 | Q13237 | 4/20 | 0.52 |
| ▸ | PRKG1 | Q13976 | 4/20 | 0.52 |
| ▸ | PKN2 | Q16513 | 4/20 | 0.52 |
| ▸ | GSK3A | P49840 | 4/20 | 0.52 |
| ▸ | MAP4K4 | O95819 | 3/20 | 0.52 |
| ▸ | PRKCG | P05129 | 3/20 | 0.52 |
| ▸ | CDK1 | P06493 | 3/20 | 0.52 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.52 |
| ▸ | CDK2 | P24941 | 3/20 | 0.52 |
| ▸ | AKT2 | P31751 | 3/20 | 0.52 |
| ▸ | CLK2 | P49760 | 3/20 | 0.52 |
| ▸ | IRAK1 | P51617 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16679599 | 0.94 | MAPK1 (1.00) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL19813035 | 0.94 | MAPK1 (1.00) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL19813071 | 0.83 | MAPK1 (1.00) | MAPK1 | |
| SCHEMBL16680028 | 0.83 | MAPK1 (1.00) | MAPK1 | |
| SCHEMBL20145449 | 0.82 | MAPK1 (0.69) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL19813060 | 0.82 | MAPK1 (1.00) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL16679393 | 0.82 | MAPK1 (1.00) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL19822287 | 0.80 | MAPK1 (0.70) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL3101800 | 0.77 | ROCK1 (0.73) | MAPK1GSK3BROCK1CLK4RPS6KA5 | |
| SCHEMBL3113017 | 0.77 | ROCK1 (0.73) | MAPK1GSK3BROCK1CLK4RPS6KA5 |
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-3063143-B1 | AMINOHETEROARYL BENZAMIDES AS KINASE INHIBITORS | NOVARTIS AG (CH) | 2018-05-16 | — | — | EP | disclosed |