Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 9/20 | 0.58 |
| ▸ | JAK2 | O60674 | 8/20 | 0.58 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.54 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.54 |
| ▸ | JAK3 | P52333 | 3/20 | 0.52 |
| ▸ | TYK2 | P29597 | 2/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 6/20 | 0.51 |
| ▸ | KDR | P35968 | 5/20 | 0.51 |
| ▸ | AURKA | O14965 | 6/20 | 0.50 |
| ▸ | CDC7 | O00311 | 1/20 | 0.48 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.48 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.48 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.48 |
| ▸ | PAK4 | O96013 | 1/20 | 0.48 |
| ▸ | PIM1 | P11309 | 1/20 | 0.48 |
| ▸ | PRKACA | P17612 | 1/20 | 0.48 |
| ▸ | CDK2 | P24941 | 1/20 | 0.48 |
| ▸ | SYK | P43405 | 1/20 | 0.48 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL15059314 | 0.99 | JAK1 (0.57) | JAK1JAK2CDK19ALKJAK3 | |
| SCHEMBL16336889 | 0.94 | JAK1 (0.56) | JAK1JAK2CDK19ALKJAK3 | |
| SCHEMBL15059571 | 0.94 | JAK1 (0.56) | JAK1JAK2CDK19ALKJAK3 | |
| SCHEMBL16337387 | 0.94 | JAK1 (0.56) | JAK1JAK2CDK19ALKJAK3 | |
| SCHEMBL16336520 | 0.89 | JAK1 (0.52) | JAK1JAK2JAK3TYK2AURKB | |
| SCHEMBL15059525 | 0.88 | JAK2 (0.55) | JAK1JAK2JAK3TYK2AURKB | |
| SCHEMBL15059526 | 0.88 | JAK2 (0.55) | JAK1JAK2JAK3TYK2AURKB | |
| SCHEMBL16337487 | 0.88 | JAK2 (0.55) | JAK1JAK2JAK3TYK2AURKB | |
| SCHEMBL15059873 | 0.85 | CDK19 (0.58) | JAK1JAK2CDK19ALKJAK3 | |
| SCHEMBL15071983 | 0.83 | JAK2 (0.58) | JAK1JAK2CDK19ALKJAK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2794598-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS | Cellzome Limited (GB) | 2014-10-29 | — | — | EP | disclosed |
| WO-2013092854-A1 | PYRIMIDINE-2,4-DIAMINE DERIVATIVES AS KINASE INHIBITORS | CELLZOME LIMITED (GB) | 2013-06-27 | — | — | WO | disclosed |