Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLK4 | O00444 | 3/20 | 0.38 |
| ▸ | PAK4 | O96013 | 2/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2A | P28223 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 4/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | JAK3 | P52333 | 4/20 | 0.32 |
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 3/20 | 0.32 |
| ▸ | JAK1 | P23458 | 3/20 | 0.32 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1662412 | 0.78 | PAK4 (0.45) | PLK4PAK4EGFRCCNA2CDK2 | |
| SCHEMBL1662982 | 0.69 | JAK3 (0.42) | PLK4PAK4EGFRCCNA2CDK2 | |
| SCHEMBL1662892 | 0.69 | JAK2 (0.47) | ALDH1A1JAK3JAK2JAK1TYK2 | |
| SCHEMBL1662557 | 0.69 | JAK3 (0.41) | PLK4PAK4HTR2CHTR2AJAK3 | |
| SCHEMBL1662830 | 0.68 | JAK3 (0.41) | PLK4PAK4HTR2CJAK3BTK | |
| SCHEMBL1663034 | 0.66 | JAK3 (0.39) | HTR2CHTR2AJAK3BTKJAK2 | |
| SCHEMBL1665417 | 0.65 | FLT4 (0.42) | PLK4PAK4JAK3BTKJAK2 | |
| SCHEMBL1665152 | 0.65 | JAK3 (0.46) | JAK3BTKJAK2JAK1TYK2 | |
| SCHEMBL1663991 | 0.65 | JAK3 (0.39) | EGFRCCNA2CDK2JAK3BTK | |
| SCHEMBL1663059 | 0.65 | JAK3 (0.49) | PLK4HTR2CHTR2AJAK3BTK |
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 |