Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 3/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.43 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.43 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CDK9 | P50750 | 2/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.43 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.43 |
| ▸ | JAK1 | P23458 | 11/20 | 0.42 |
| ▸ | TYK2 | P29597 | 9/20 | 0.42 |
| ▸ | JAK3 | P52333 | 8/20 | 0.42 |
| ▸ | JAK2 | O60674 | 13/20 | 0.42 |
| ▸ | STAT3 | P40763 | 2/20 | 0.42 |
| ▸ | FLT3 | P36888 | 5/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4562646 | 0.88 | JAK2 (0.48) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4561138 | 0.87 | JAK2 (0.49) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4560798 | 0.86 | JAK3 (0.48) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4560697 | 0.86 | JAK2 (0.47) | CCNT1CCNE1CDK2CDK9JAK1 | |
| SCHEMBL4562163 | 0.84 | CDK1 (0.43) | CDK1CCNT1CCNB2CCNE2CCNB1 | |
| SCHEMBL4560571 | 0.84 | JAK3 (0.42) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4561601 | 0.84 | JAK3 (0.42) | JAK1TYK2JAK3JAK2STAT3 | |
| SCHEMBL4559060 | 0.83 | JAK2 (0.44) | JAK1TYK2JAK3JAK2FLT3 | |
| SCHEMBL27935913 | 0.83 | JAK2 (0.49) | CDK1CCNT1CCNB2CCNE2CCNB1 | |
| SCHEMBL4561925 | 0.82 | JAK2 (0.39) | CCNE1CDK2JAK1TYK2JAK3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2638018-A1 | PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS | Cellzome Limited (GB) | 2013-09-18 | — | — | EP | claimed |
| WO-2012062704-A1 | PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS | CELLZOME LIMITED (GB) | 2012-05-18 | — | — | WO | claimed |
| EP-2638018-A1 | PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS | Cellzome Limited (GB) | 2013-09-18 | — | — | EP | disclosed |
| WO-2012062704-A1 | PYRIDINE COMPOUNDS AND AZA ANALOGUES THEREOF AS TYK2 INHIBITORS | CELLZOME LIMITED (GB) | 2012-05-18 | — | — | WO | disclosed |