Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 9/20 | 0.59 |
| ▸ | VNN1 | O95497 | 5/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.45 |
| ▸ | CDK2 | P24941 | 3/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL14301729 | 0.91 | GSK3B (0.55) | GSK3BVNN1MAPTCHEK1CCNE1 | |
| SCHEMBL13288831 | 0.90 | GSK3B (0.59) | GSK3BALDH1A1CHEK1CCNE1CDK2 | |
| SCHEMBL13119031 | 0.90 | GSK3B (0.74) | GSK3BCCNE1CDK2 | |
| SCHEMBL13288822 | 0.90 | GSK3B (0.55) | GSK3BCHEK1CCNE1CDK2 | |
| SCHEMBL13288839 | 0.90 | GSK3B (0.56) | GSK3BVNN1CHEK1CCNE1CDK2 | |
| SCHEMBL12954326 | 0.89 | GSK3B (0.58) | GSK3BCHEK1CCNE1CDK2 | |
| SCHEMBL13288823 | 0.89 | GSK3B (0.53) | GSK3BVNN1CHEK1CCNE1CDK2 | |
| SCHEMBL12953866 | 0.89 | GSK3B (0.54) | GSK3BVNN1CHEK1CCNE1CDK2 | |
| SCHEMBL13288814 | 0.89 | GSK3B (0.61) | GSK3BCHEK1CCNE1CDK2 | |
| SCHEMBL13305370 | 0.89 | GSK3B (0.61) | GSK3BVNN1CHEK1CCNE1CDK2 |
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-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |