Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 7/20 | 0.50 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.45 |
| ▸ | VNN1 | O95497 | 3/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 3/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13288627 | 0.92 | GSK3B (0.52) | GSK3BCHEK1VNN1CDK2HTT | |
| SCHEMBL13119170 | 0.92 | GSK3B (0.62) | GSK3BCDK2CCNE1 | |
| SCHEMBL12954328 | 0.88 | GSK3B (0.47) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL12954085 | 0.86 | GSK3B (0.51) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL14301565 | 0.86 | GSK3B (0.53) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL14307159 | 0.85 | GSK3B (0.52) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL13118903 | 0.84 | GSK3B (0.65) | GSK3BCDK2CCNE1 | |
| SCHEMBL13304610 | 0.84 | GSK3B (0.59) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL13304611 | 0.84 | GSK3B (0.59) | GSK3BCHEK1VNN1CDK2CCNE1 | |
| SCHEMBL13305284 | 0.84 | GSK3B (0.59) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008130569-A1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-10-30 | — | — | WO | disclosed |