Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 18/20 | 0.76 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.76 |
| ▸ | CDK2 | P24941 | 4/20 | 0.76 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.76 |
| ▸ | GSK3B | P49841 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL14232210 | 0.87 | CHEK1 (0.75) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL11930922 | 0.86 | CHEK1 (1.00) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14231850 | 0.85 | CHEK1 (0.60) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14232211 | 0.85 | CHEK1 (0.75) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL13845497 | 0.83 | CHEK1 (0.76) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14231851 | 0.83 | CHEK1 (0.72) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14231853 | 0.82 | CHEK1 (0.61) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14232212 | 0.82 | CHEK1 (0.74) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14218885 | 0.82 | CHEK1 (0.65) | CHEK1CCNA2CDK2CCNA1 | |
| SCHEMBL14231852 | 0.81 | CHEK1 (0.75) | CHEK1CCNA2CDK2CCNA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009061781-A1 | NOVEL MODULATORS OF CELL CYCLE CHECKPOINTS AND THEIR USE IN COMBINATION WITH CHECKPOINT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2009-05-14 | — | — | WO | disclosed |
| WO-2008045267-A2 | PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | SCHERING CORPORATION (US) | 2008-04-17 | — | — | WO | disclosed |