Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 8/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | VNN1 | O95497 | 2/20 | 0.42 |
| ▸ | CDK2 | P24941 | 3/20 | 0.42 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.42 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13118856 | 0.91 | GSK3B (0.71) | GSK3BCDK2CCNE1 | |
| SCHEMBL13289048 | 0.88 | GSK3B (0.59) | GSK3BALDH1A1CHEK1VNN1CDK2 | |
| SCHEMBL13305370 | 0.87 | GSK3B (0.61) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL12953848 | 0.87 | GSK3B (0.61) | GSK3BCHEK1CDK2CCNE1 | |
| SCHEMBL13288814 | 0.87 | GSK3B (0.61) | GSK3BCHEK1CDK2CCNE1 | |
| SCHEMBL13288837 | 0.87 | GSK3B (0.57) | GSK3BKDM4EALDH1A1CHEK1VNN1 | |
| SCHEMBL13288839 | 0.86 | GSK3B (0.56) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL13289050 | 0.85 | GSK3B (0.58) | GSK3BCHEK1CDK2CCNE1 | |
| SCHEMBL13288625 | 0.85 | GSK3B (0.56) | GSK3BALDH1A1CHEK1VNN1CDK2 | |
| SCHEMBL13289043 | 0.85 | GSK3B (0.63) | GSK3BCHEK1VNN1CDK2CCNE1 |
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-2194058-A1 | Pyrazolopyrimidines suitable for the treatment of cancer diseases | SCHERING CORPORATION (US) | 2010-06-09 | — | — | EP | disclosed |
| WO-2008130570-A1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |