Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 6/20 | 0.62 |
| ▸ | CCND1 | P24385 | 6/20 | 0.62 |
| ▸ | CCND3 | P30281 | 5/20 | 0.49 |
| ▸ | CDK6 | Q00534 | 5/20 | 0.49 |
| ▸ | CDK1 | P06493 | 3/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.48 |
| ▸ | CDK2 | P24941 | 3/20 | 0.48 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.48 |
| ▸ | WNT1 | P04628 | 3/20 | 0.34 |
| ▸ | GSK3B | P49841 | 3/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
| ▸ | CLK3 | P49761 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.33 |
| ▸ | KIT | P10721 | 2/20 | 0.32 |
| ▸ | FLT3 | P36888 | 2/20 | 0.32 |
| ▸ | ATR | Q13535 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL112177 | 0.91 | CDK4 (0.75) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL2142195 | 0.90 | CDK4 (0.58) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL111515 | 0.85 | CDK4 (0.57) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL27880987 | 0.81 | CDK4 (0.52) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL110439 | 0.80 | CDK4 (0.51) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL113839 | 0.79 | CDK4 (0.50) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL114897 | 0.78 | CDK4 (0.44) | CDK4CCND1KIT | |
| SCHEMBL114117 | 0.77 | CDK4 (0.78) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL110731 | 0.77 | CDK4 (1.00) | CDK4CCND1CCND3CDK6CDK1 | |
| SCHEMBL112120 | 0.76 | CDK4 (0.55) | 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 |
|---|---|---|---|---|---|---|---|
| CN-102803225-A | Imidazole derivatives and their use as modulators of cyclin dependent kinases | NOVARTIS AG | 2012-11-28 | — | — | CN | disclosed |