Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 19/20 | 0.59 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.53 |
| ▸ | CDK2 | P24941 | 3/20 | 0.53 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.53 |
| ▸ | AXL | P30530 | 1/20 | 0.49 |
| ▸ | TYRO3 | Q06418 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11931599 | 0.90 | CHEK1 (0.54) | CHEK1CCNA2CDK2CCNA1AXL | |
| SCHEMBL11931087 | 0.86 | CHEK1 (0.79) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL11931583 | 0.86 | CHEK1 (0.51) | CHEK1CCNA2CDK2CCNA1AXL | |
| SCHEMBL16784428 | 0.80 | CHEK1 (0.76) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL11931604 | 0.77 | CHEK1 (0.69) | CHEK1CCNA2CDK2CCNA1AXL | |
| SCHEMBL14218630 | 0.75 | PIK3CA (0.41) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL11931588 | 0.74 | CHEK1 (0.65) | CHEK1CCNA2CDK2CCNA1AXL | |
| SCHEMBL11931093 | 0.74 | CHEK1 (1.00) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14218615 | 0.74 | CHEK1 (0.61) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL11931606 | 0.73 | CHEK1 (0.52) | CHEK1CCNA2CDK2CCNA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2069348-B1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2015-12-30 | — | — | EP | disclosed |