Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK2 | O43353 | 2/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 8/20 | 0.43 |
| ▸ | GSK3B | P49841 | 7/20 | 0.43 |
| ▸ | PIM1 | P11309 | 6/20 | 0.43 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.43 |
| ▸ | JAK2 | O60674 | 1/20 | 0.43 |
| ▸ | PAK4 | O96013 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.42 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.41 |
| ▸ | CLK2 | P49760 | 3/20 | 0.41 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.41 |
| ▸ | CDC7 | O00311 | 3/20 | 0.41 |
| ▸ | DYRK3 | O43781 | 2/20 | 0.41 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.41 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.41 |
| ▸ | CDK1 | P06493 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL17514101 | 0.77 | HSP90AA1 (0.48) | RIPK2PIK3CDROCK2GSK3BPIM1 | |
| SCHEMBL4183271 | 0.75 | CFTR (0.47) | PIK3CDMAPK1 | |
| SCHEMBL16709634 | 0.74 | KEAP1 (0.49) | PIK3CDROCK2JAK2KDR | |
| SCHEMBL29938346 | 0.72 | SCN9A (0.43) | — | |
| SCHEMBL31747436 | 0.72 | MKNK1 (0.46) | JAK2MAPKAPK2MKNK2 | |
| SCHEMBL9952896 | 0.72 | NAMPT (0.50) | PIK3CD | |
| SCHEMBL31110487 | 0.72 | NAMPT (0.50) | PIK3CD | |
| SCHEMBL25322160 | 0.70 | PIK3CD (0.46) | RIPK2PIK3CDROCK2GSK3BPIM1 | |
| SCHEMBL24365179 | 0.70 | PIK3CD (0.46) | RIPK2PIK3CDROCK2GSK3BPIM1 | |
| SCHEMBL30551259 | 0.70 | PIK3CD (0.46) | RIPK2PIK3CDROCK2GSK3BPIM1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112739691-B | TRK inhibitors as anticancer agents | 泰励生物科技（上海）有限公司 | 2023-05-23 | — | — | CN | disclosed |