Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 17/20 | 0.58 |
| ▸ | CDK4 | P11802 | 16/20 | 0.58 |
| ▸ | CCND1 | P24385 | 16/20 | 0.58 |
| ▸ | CDK2 | P24941 | 16/20 | 0.58 |
| ▸ | CASK | O14936 | 1/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.41 |
| ▸ | STK10 | O94804 | 1/20 | 0.41 |
| ▸ | CDK14 | O94921 | 1/20 | 0.41 |
| ▸ | ABL1 | P00519 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | MAK | P20794 | 1/20 | 0.41 |
| ▸ | CDK11B | P21127 | 1/20 | 0.41 |
| ▸ | TTK | P33981 | 1/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | CLK3 | P49761 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CDK7 | P50613 | 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 | |
|---|---|---|---|---|
| SCHEMBL3840949 | 0.93 | CDK1 (0.58) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3836166 | 0.93 | CDK1 (0.58) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3838032 | 0.91 | CDK1 (0.56) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3835597 | 0.91 | CDK1 (0.59) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3835761 | 0.90 | CDK1 (0.55) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3841462 | 0.89 | CDK1 (0.61) | CDK1CDK4CCND1CDK2 | |
| SCHEMBL3837582 | 0.89 | CDK1 (0.61) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3836174 | 0.89 | CDK1 (0.54) | CDK1CDK4CCND1CDK2SYK | |
| SCHEMBL3835786 | 0.88 | CDK1 (0.57) | CDK1CDK4CCND1CDK2CASK | |
| SCHEMBL3837049 | 0.87 | CDK1 (0.75) | CDK1CDK4CCND1CDK2CASK |
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 |
|---|---|---|---|---|---|---|---|
| EP-1771420-B1 | NOVEL 2,6-DIAMINOPYRIDINE-3-ONE DERIVATIVES | HOFFMANN LA ROCHE (CH) | 2009-10-14 | — | — | EP | claimed |