Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 13/20 | 0.39 |
| ▸ | JAK3 | P52333 | 10/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | JAK1 | P23458 | 10/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | TYK2 | P29597 | 6/20 | 0.38 |
| ▸ | STAT3 | P40763 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 3/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | CDK2 | P24941 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4561635 | 0.88 | JAK2 (0.40) | JAK2JAK3JAK1HDAC1HDAC6 | |
| SCHEMBL4559046 | 0.85 | JAK1 (0.49) | JAK2JAK3JAK1TYK2STAT3 | |
| SCHEMBL4559528 | 0.82 | CDK1 (0.43) | JAK2JAK3JAK1TYK2STAT3 | |
| SCHEMBL4560697 | 0.82 | JAK2 (0.47) | JAK2JAK3NAMPTJAK1HDAC1 | |
| SCHEMBL5021903 | 0.81 | ALDH1A1 (0.45) | JAK2JAK3JAK1HDAC1HDAC6 | |
| SCHEMBL4562646 | 0.78 | JAK2 (0.48) | JAK2JAK3JAK1TYK2STAT3 | |
| SCHEMBL4561138 | 0.77 | JAK2 (0.49) | JAK2JAK3JAK1TYK2STAT3 | |
| SCHEMBL4560798 | 0.77 | JAK3 (0.48) | JAK2JAK3JAK1TYK2STAT3 | |
| SCHEMBL4560571 | 0.75 | JAK3 (0.42) | JAK2JAK3JAK1HDAC6TYK2 | |
| SCHEMBL4561617 | 0.74 | JAK1 (0.53) | JAK2JAK3JAK1TYK2STAT3 |
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 |