Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 2/20 | 0.39 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.39 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.39 |
| ▸ | FLT1 | P17948 | 1/20 | 0.39 |
| ▸ | MARK3 | P27448 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.39 |
| ▸ | CLK2 | P49760 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.39 |
| ▸ | PRKD1 | Q15139 | 1/20 | 0.39 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.39 |
| ▸ | PHKG1 | Q16816 | 1/20 | 0.39 |
| ▸ | MAPK15 | Q8TD08 | 1/20 | 0.39 |
| ▸ | BRSK1 | Q8TDC3 | 1/20 | 0.39 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15392128 | 1.00 | CHEK1 (0.39) | CHEK1NUAK1CHEK2CDK1CCNB1 | |
| SCHEMBL19807201 | 0.87 | EPHA2 (0.43) | LRRK2 | |
| SCHEMBL18896596 | 0.87 | EPHA2 (0.43) | LRRK2 | |
| SCHEMBL16693739 | 0.87 | EPHA2 (0.43) | LRRK2 | |
| SCHEMBL30186246 | 0.84 | ENPP2 (0.38) | CHEK1NUAK1CHEK2CDK1CCNB1 | |
| SCHEMBL29068397 | 0.80 | CHEK1 (0.65) | CHEK1NUAK1CHEK2CDK1CCNB1 | |
| SCHEMBL16681073 | 0.80 | CHEK1 (0.65) | CHEK1NUAK1CHEK2CDK1CCNB1 | |
| SCHEMBL26976877 | 0.79 | DRD4 (0.40) | CHEK1KDRLRRK2DRD4 | |
| SCHEMBL620442 | 0.77 | CHEK1 (0.44) | CHEK1KDRLRRK2DRD4 | |
| SCHEMBL25495034 | 0.76 | PDE3B (0.44) | CHEK1NUAK1CHEK2CDK1CCNB1 |
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-115443271-A | Synthetic method of CHK1 inhibitor | 塞拉肿瘤学股份有限公司 | 2022-12-06 | — | — | CN | disclosed |