Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.36 |
| ▸ | GBA1 | P04062 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 4/20 | 0.34 |
| ▸ | PAK4 | O96013 | 2/20 | 0.34 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.34 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 2/20 | 0.34 |
| ▸ | JAK1 | P23458 | 2/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | TTK | P33981 | 2/20 | 0.32 |
| ▸ | AXL | P30530 | 1/20 | 0.32 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.32 |
| ▸ | MERTK | Q12866 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1662522 | 0.77 | PTK6 (0.42) | LRRK2PLK4PAK4HTR2AHTR2C | |
| SCHEMBL1664795 | 0.73 | JAK3 (0.44) | LRRK2PDCD1CD274JAK2ALDH1A1 | |
| SCHEMBL22299750 | 0.66 | LRRK2 (0.39) | LRRK2PDCD1CD274JAK2JAK1 | |
| SCHEMBL12801992 | 0.66 | LRRK2 (0.37) | LRRK2PLK4PAK4JAK2JAK1 | |
| SCHEMBL1663991 | 0.64 | JAK3 (0.39) | JAK2JAK1AXLTYRO3MERTK | |
| SCHEMBL1662898 | 0.64 | JAK3 (0.39) | LRRK2JAK2JAK1HTR2AHTR2C | |
| SCHEMBL1662894 | 0.64 | PLK4 (0.38) | PLK4PAK4JAK2JAK1HTR2A | |
| SCHEMBL5569386 | 0.64 | PARP1 (0.47) | PLK4PAK4HTR2AHTR2CALDH1A1 | |
| SCHEMBL12796184 | 0.63 | JAK3 (0.39) | LRRK2JAK2JAK1 | |
| SCHEMBL12797055 | 0.63 | JAK3 (0.41) | LRRK2JAK2JAK1P2RX7ALDH1A1 |
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 |