Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNA2 | P20248 | 2/20 | 0.53 |
| ▸ | CDK2 | P24941 | 2/20 | 0.53 |
| ▸ | CDK1 | P06493 | 1/20 | 0.48 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 8/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | LYN | P07948 | 1/20 | 0.45 |
| ▸ | GRK2 | P25098 | 1/20 | 0.45 |
| ▸ | CLK1 | P49759 | 1/20 | 0.45 |
| ▸ | GSK3A | P49840 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | MAPK7 | Q13164 | 1/20 | 0.45 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.45 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | BCL3 | P20749 | 1/20 | 0.41 |
| ▸ | PIM1 | P11309 | 1/20 | 0.41 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.41 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8219161 | 0.91 | CCNA2 (0.63) | CCNA2CDK2CDK1CCNB1GSK3B | |
| SCHEMBL13543788 | 0.90 | CCNA2 (0.48) | CCNA2CDK2CDK1CCNB1GSK3B | |
| SCHEMBL8261337 | 0.88 | CCNA2 (0.57) | CCNA2CDK2CDK1CCNB1GSK3B | |
| SCHEMBL8219257 | 0.87 | CDK2 (0.56) | CCNA2CDK2CDK1CCNB1PIM1 | |
| SCHEMBL8228035 | 0.86 | CCNA2 (0.55) | CCNA2CDK2GSK3BKCNH2BCL3 | |
| SCHEMBL953496 | 0.85 | DYRK1A (0.51) | CCNA2CDK2CDK1CCNB1DYRK1A | |
| SCHEMBL8228006 | 0.83 | CDK2 (0.49) | CCNA2CDK2CDK1CCNB1GSK3B | |
| SCHEMBL8219744 | 0.82 | CDK2 (0.50) | CCNA2CDK2CDK1CCNB1ADORA2A | |
| SCHEMBL8262274 | 0.82 | CDK2 (0.50) | CCNA2CDK2CDK1CCNB1ADORA2A | |
| SCHEMBL1286718 | 0.82 | CDK2 (0.50) | CCNA2CDK2CDK1CCNB1GSK3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1651612-B9 | 3,4-DISUBSTITUTED 1H-PYRAZOLE COMPOUNDS AND THEIR USE AS CYCLIN DEPENDENT KINASES (CDK) AND GLYCOGEN SYNTHASE KINASE-3 (GSK-3) MODULATORS | ASTEX THERAPEUTICS LTD (GB) | 2012-09-05 | — | — | EP | disclosed |
| WO-2008007113-A2 | PHARMACEUTICAL COMBINATIONS | ASTEX THERAPEUTICS LIMITED (GB) | 2008-01-17 | — | — | WO | disclosed |