Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 6/20 | 0.41 |
| ▸ | CDK2 | P24941 | 3/20 | 0.39 |
| ▸ | GSK3B | P49841 | 3/20 | 0.39 |
| ▸ | JAK1 | P23458 | 1/20 | 0.36 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.36 |
| ▸ | GPR35 | Q9HC97 | 2/20 | 0.36 |
| ▸ | GPR55 | Q9Y2T6 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11931564 | 0.91 | CHEK1 (0.49) | CHEK1CDK2 | |
| SCHEMBL14219070 | 0.89 | CHEK1 (0.40) | CHEK1CDK2GSK3BJAK1GPR119 | |
| SCHEMBL14219069 | 0.86 | CHEK1 (0.44) | CHEK1JAK1GPR119PIK3CAROCK2 | |
| SCHEMBL14218632 | 0.85 | CHEK1 (0.45) | CHEK1JAK1GPR119PIK3CAROCK2 | |
| SCHEMBL14219068 | 0.84 | JAK2 (0.43) | CHEK1JAK1GPR119PIK3CAROCK2 | |
| SCHEMBL14218794 | 0.84 | CHEK1 (0.55) | CHEK1CDK2GSK3B | |
| SCHEMBL14218631 | 0.83 | CHEK1 (0.43) | CHEK1JAK1GPR119PIK3CAROCK2 | |
| SCHEMBL14219067 | 0.83 | CHEK1 (0.55) | CHEK1CDK2JAK1GPR119PIK3CA | |
| SCHEMBL11931560 | 0.82 | CHEK1 (0.53) | CHEK1CDK2GSK3B | |
| SCHEMBL14232556 | 0.82 | CHEK1 (0.47) | CHEK1JAK1GPR119PIK3CAROCK2 |
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-2008045268-A2 | PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |