Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK4 | O00444 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.42 |
| ▸ | JAK3 | P52333 | 4/20 | 0.40 |
| ▸ | BTK | Q06187 | 2/20 | 0.40 |
| ▸ | JAK2 | O60674 | 3/20 | 0.40 |
| ▸ | JAK1 | P23458 | 3/20 | 0.40 |
| ▸ | TYK2 | P29597 | 3/20 | 0.40 |
| ▸ | MARK3 | P27448 | 1/20 | 0.39 |
| ▸ | WNT1 | P04628 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 1/20 | 0.37 |
| ▸ | CCND1 | P24385 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.37 |
| ▸ | CDK1 | P06493 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1662711 | 0.83 | JAK3 (0.42) | PLK4JAK3BTKJAK2JAK1 | |
| SCHEMBL1662994 | 0.80 | PLK4 (0.53) | PLK4JAK3BTKJAK2JAK1 | |
| SCHEMBL1662386 | 0.79 | PLK4 (0.50) | PLK4JAK3BTKJAK2HSP90AA1 | |
| SCHEMBL1663011 | 0.78 | TTK (0.45) | PLK4JAK3BTKJAK2EGFR | |
| SCHEMBL14811478 | 0.77 | JAK3 (0.44) | JAK3BTKJAK2JAK1EGFR | |
| SCHEMBL672966 | 0.76 | JAK3 (0.48) | JAK3JAK2JAK1TYK2MARK3 | |
| SCHEMBL12002573 | 0.76 | PLK4 (0.51) | PLK4JAK3BTKJAK2JAK1 | |
| SCHEMBL1662604 | 0.74 | PLK4 (0.47) | PLK4JAK3BTKJAK2JAK1 | |
| SCHEMBL1665417 | 0.74 | FLT4 (0.42) | PLK4JAK3BTKJAK2JAK1 | |
| SCHEMBL1662557 | 0.73 | JAK3 (0.41) | PLK4JAK3BTKJAK2JAK1 |
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-2491039-A1 | HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS | Cellzome Limited (GB) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011048082-A1 | HETEROCYCLYL PYRAZOLOPYRIMIDINE ANALOGUES AS JAK INHIBITORS | CELLZOME LIMITED (GB) | 2011-04-28 | — | — | WO | disclosed |