Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | GSK3A | P49840 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 13/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 13/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 12/20 | 0.44 |
| ▸ | JAK2 | O60674 | 2/20 | 0.40 |
| ▸ | JAK1 | P23458 | 2/20 | 0.40 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | STK17B | O94768 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | JAK3 | P52333 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18398433 | 0.84 | GSK3B (0.43) | GSK3BCDK2GSK3AHDAC1HDAC2 | |
| SCHEMBL18409114 | 0.83 | TYK2 (0.46) | GSK3BGSK3AJAK2JAK1MAPK14 | |
| SCHEMBL18398581 | 0.81 | JAK2 (0.53) | GSK3BJAK2JAK1TYK2JAK3 | |
| SCHEMBL18409360 | 0.77 | MEN1 (0.36) | — | |
| SCHEMBL18409287 | 0.76 | JAK2 (0.47) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL18409202 | 0.76 | TYK2 (0.53) | JAK2JAK1TYK2JAK3 | |
| SCHEMBL15173577 | 0.75 | BTK (0.39) | HDAC1HDAC2HDAC3 | |
| SCHEMBL18409108 | 0.75 | JAK1 (0.47) | GSK3BCDK2GSK3AJAK2JAK1 | |
| SCHEMBL18409103 | 0.75 | JAK2 (0.43) | GSK3BCDK2JAK2JAK1MAPK14 | |
| SCHEMBL18409176 | 0.73 | TYK2 (0.48) | GSK3BJAK2JAK1TYK2JAK3 |
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-2017012647-A1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF INFLAMMATORY DISORDERS | GALAPAGOS NV (BE) | 2017-01-26 | — | — | WO | disclosed |