Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 5/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | FAAH | O00519 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | CDK2 | P24941 | 5/20 | 0.42 |
| ▸ | VNN1 | O95497 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL13121523 | 0.92 | GSK3B (0.65) | GSK3BCDK2CCNE1 | |
| SCHEMBL14043406 | 0.92 | GSK3B (0.56) | GSK3BCHEK1FAAHNAMPTCDK2 | |
| SCHEMBL14613495 | 0.91 | GSK3B (0.51) | GSK3BCHEK1FAAHCDK2VNN1 | |
| SCHEMBL14545284 | 0.89 | GSK3B (0.53) | GSK3BCHEK1FAAHNAMPTCDK2 | |
| SCHEMBL14307170 | 0.88 | GSK3B (0.52) | GSK3BCHEK1FAAHCDK2VNN1 | |
| SCHEMBL14051039 | 0.88 | GSK3B (0.50) | GSK3BCHEK1FAAHNAMPTCDK2 | |
| SCHEMBL14545281 | 0.88 | GSK3B (0.50) | GSK3BCHEK1FAAHPOLB | |
| SCHEMBL14418709 | 0.87 | GSK3B (0.57) | GSK3BCHEK1CDK2VNN1CCNE1 | |
| SCHEMBL14418708 | 0.87 | GSK3B (0.52) | GSK3BCHEK1CDK2VNN1CCNE1 | |
| SCHEMBL13304610 | 0.87 | GSK3B (0.59) | GSK3BCHEK1CDK2VNN1CCNE1 |
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-1720882-B1 | PYRAZOLOPYRIMIDINE-DERIVATIVES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORP (US) | 2011-01-05 | — | — | EP | disclosed |