Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 19/20 | 0.79 |
| ▸ | CDK2 | P24941 | 18/20 | 0.79 |
| ▸ | CDK4 | P11802 | 17/20 | 0.79 |
| ▸ | CCND1 | P24385 | 17/20 | 0.79 |
| ▸ | CDK9 | P50750 | 2/20 | 0.71 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.71 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.71 |
| ▸ | CASK | O14936 | 1/20 | 0.71 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.71 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.71 |
| ▸ | STK10 | O94804 | 1/20 | 0.71 |
| ▸ | CDK14 | O94921 | 1/20 | 0.71 |
| ▸ | ABL1 | P00519 | 1/20 | 0.71 |
| ▸ | EGFR | P00533 | 1/20 | 0.71 |
| ▸ | MAK | P20794 | 1/20 | 0.71 |
| ▸ | CDK11B | P21127 | 1/20 | 0.71 |
| ▸ | TTK | P33981 | 1/20 | 0.71 |
| ▸ | CLK1 | P49759 | 1/20 | 0.71 |
| ▸ | CLK2 | P49760 | 1/20 | 0.71 |
| ▸ | CLK3 | P49761 | 1/20 | 0.71 |
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 | |
|---|---|---|---|---|
| SCHEMBL4348415 | 0.90 | CDK2 (0.80) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL3522558 | 0.88 | CDK1 (1.00) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL4355436 | 0.85 | CDK1 (0.86) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL4359143 | 0.85 | CDK2 (0.74) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL4350447 | 0.84 | CDK1 (0.87) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL3520595 | 0.84 | CDK1 (0.79) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL4355426 | 0.83 | CDK1 (1.00) | CDK1CDK2CDK4CCND1CDK9 | |
| Rg-547 SCHEMBL2397067 | 0.83 | CDK1 (1.00) | CDK1CDK2CDK4CCND1CDK9 | |
| Rg-547 SCHEMBL29644949 | 0.83 | CDK1 (1.00) | CDK1CDK2CDK4CCND1CDK9 | |
| SCHEMBL4350211 | 0.83 | CDK1 (0.82) | CDK1CDK2CDK4CCND1CDK9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7615634-B2 | 4-aminopyrimidine-5-one derivatives | HOFFMANN-LA ROCHE INC. (US) | 2009-11-10 | — | — | US | disclosed |
| US-7615634-B2 | 4-aminopyrimidine-5-one derivatives | HOFFMANN-LA ROCHE INC. (US) | 2009-11-10 | — | — | US | disclosed |
| US-7157455-B2 | 4-Aminopyrimidine-5-one derivatives | HOFFMANN-LA ROCHE INC. (US) | 2007-01-02 | — | — | US | disclosed |