Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 6/20 | 0.48 |
| ▸ | TYK2 | P29597 | 6/20 | 0.48 |
| ▸ | JAK3 | P52333 | 5/20 | 0.48 |
| ▸ | JAK2 | O60674 | 4/20 | 0.48 |
| ▸ | STAT3 | P40763 | 2/20 | 0.48 |
| ▸ | AXL | P30530 | 5/20 | 0.46 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | GSK3B | P49841 | 1/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 2/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | BTK | Q06187 | 1/20 | 0.40 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.39 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.39 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.39 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4561887 | 0.90 | JAK1 (0.50) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4536557 | 0.90 | JAK2 (0.50) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4543495 | 0.90 | JAK1 (0.50) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4561938 | 0.89 | JAK1 (0.49) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL29754155 | 0.88 | JAK1 (0.52) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4561798 | 0.88 | JAK1 (0.52) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL22546295 | 0.86 | JAK2 (0.61) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL29754219 | 0.86 | JAK2 (0.61) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4561182 | 0.86 | JAK1 (0.52) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4558958 | 0.85 | JAK1 (0.49) | JAK1TYK2JAK3JAK2STAT3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012062704-A1 | PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS | CELLZOME LIMITED (GB) | 2012-05-18 | — | — | WO | disclosed |