Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 5/20 | 0.78 |
| ▸ | CCND1 | P24385 | 5/20 | 0.78 |
| ▸ | CCND3 | P30281 | 4/20 | 0.78 |
| ▸ | CDK6 | Q00534 | 4/20 | 0.78 |
| ▸ | CDK1 | P06493 | 2/20 | 0.78 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.78 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.68 |
| ▸ | CDK2 | P24941 | 2/20 | 0.68 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.68 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | ATR | Q13535 | 4/20 | 0.42 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.42 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.42 |
| ▸ | KDM5A | P29375 | 1/20 | 0.40 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.40 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL111810 | 0.92 | CDK4 (0.83) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL111954 | 0.88 | CDK4 (1.00) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL112922 | 0.86 | CDK4 (0.73) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL109669 | 0.85 | CDK4 (0.79) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL112342 | 0.85 | CDK4 (0.81) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL109487 | 0.85 | CDK4 (0.73) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL113316 | 0.85 | CDK4 (0.75) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL112736 | 0.84 | CDK4 (0.72) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL110729 | 0.84 | CDK4 (0.74) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL114255 | 0.84 | CDK4 (0.74) | CDK4CCND1CCND3CDK6CDK1 |
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-2010125402-A1 | IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES | NOVARTIS AG (CH) | 2010-11-04 | — | — | WO | disclosed |