Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.43 |
| ▸ | GSK3B | P49841 | 5/20 | 0.37 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | HTR1B | P28222 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR1E | P28566 | 1/20 | 0.32 |
| ▸ | HTR7 | P34969 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | HTR3A | P46098 | 1/20 | 0.32 |
| ▸ | HTR5A | P47898 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14545936 | 0.83 | LRRK2 (0.36) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL14413501 | 0.82 | CHEK1 (0.41) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL14545930 | 0.81 | CHEK1 (0.34) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL14050983 | 0.79 | PDE4B (0.43) | CDK2CHEK1CCNA2CCNA1 | |
| SCHEMBL11930869 | 0.78 | CHEK1 (0.61) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL14542953 | 0.77 | CHEK1 (0.73) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL11931324 | 0.76 | TRPV3 (0.42) | CDK2CHEK1CCNA2CCNA1 | |
| SCHEMBL14413493 | 0.72 | CHEK1 (0.32) | CDK2CHEK1CCNA2CCNA1 | |
| SCHEMBL10460653 | 0.70 | GSK3B (0.49) | CDK2CHEK1CCNA2CCNA1GSK3B | |
| SCHEMBL14413496 | 0.70 | CHEK1 (0.34) | CDK2CHEK1CCNA2CCNA1 |
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-2007044449-A2 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2007-04-19 | — | — | WO | disclosed |