Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 20/20 | 0.74 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.69 |
| ▸ | ABL1 | P00519 | 1/20 | 0.69 |
| ▸ | PRKCB | P05771 | 1/20 | 0.69 |
| ▸ | FYN | P06241 | 1/20 | 0.69 |
| ▸ | CDK1 | P06493 | 1/20 | 0.69 |
| ▸ | LYN | P07948 | 1/20 | 0.69 |
| ▸ | MET | P08581 | 1/20 | 0.69 |
| ▸ | HCK | P08631 | 1/20 | 0.69 |
| ▸ | SRC | P12931 | 1/20 | 0.69 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.69 |
| ▸ | PRKCA | P17252 | 1/20 | 0.69 |
| ▸ | CDK2 | P24941 | 1/20 | 0.69 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.69 |
| ▸ | MAP4K2 | Q12851 | 1/20 | 0.69 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.69 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.69 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.69 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.69 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.69 |
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 | |
|---|---|---|---|---|
| SCHEMBL1016740 | 0.89 | BRAF (0.75) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1020203 | 0.88 | BRAF (0.59) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1015847 | 0.85 | BRAF (1.00) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1015620 | 0.82 | BRAF (1.00) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1017054 | 0.79 | BRAF (1.00) | BRAFCHEK1ABL1PRKCBFYN | |
| Trifluoroacetic Acid SCHEMBL1015096 | 0.76 | BRAF (0.87) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1015133 | 0.75 | BRAF (0.82) | BRAFCHEK1ABL1PRKCBFYN | |
| Trifluoroacetic Acid SCHEMBL1016961 | 0.74 | BRAF (0.88) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1012983 | 0.74 | BRAF (1.00) | BRAFCHEK1ABL1PRKCBFYN | |
| SCHEMBL1016593 | 0.73 | BRAF (0.80) | BRAFCHEK1ABL1PRKCBFYN |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2271649-A1 | BRIDGED, BICYCLIC HETEROCYCLIC OR SPIRO BICYCLIC HETEROCYCLIC DERIVATIVES OF PYRAZOLO[1,5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF | Wyeth LLC (US) | 2011-01-12 | — | — | EP | claimed |
| WO-2009108838-A1 | BRIDGED, BICYCLIC HETEROCYCLIC OR SPIRO BICYCLIC HETEROCYCLIC DERIVATIVES OF PYRAZOLO[1,5-A]PYRIMIDINES, METHODS FOR PREPARATION AND USES THEREOF | WYETH (US) | 2009-09-03 | — | — | WO | claimed |