Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 11/20 | 0.53 |
| ▸ | CDK6 | Q00534 | 10/20 | 0.53 |
| ▸ | CCND3 | P30281 | 5/20 | 0.53 |
| ▸ | CCND1 | P24385 | 4/20 | 0.53 |
| ▸ | EGFR | P00533 | 9/20 | 0.50 |
| ▸ | CDK2 | P24941 | 7/20 | 0.44 |
| ▸ | CDK1 | P06493 | 3/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
| ▸ | CDK7 | P50613 | 2/20 | 0.42 |
| ▸ | CDK9 | P50750 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL20987199 | 1.00 | CDK4 (0.53) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL29669654 | 0.88 | CDK4 (0.55) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL2514899 | 0.88 | CDK4 (0.55) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL19836706 | 0.86 | CDK4 (0.54) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL19836272 | 0.86 | CDK4 (0.51) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL20987197 | 0.84 | EGFR (0.46) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL21522745 | 0.83 | CDK4 (0.54) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL22172140 | 0.83 | EGFR (0.46) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL30888974 | 0.83 | CDK4 (0.54) | CDK4CDK6CCND3CCND1EGFR | |
| SCHEMBL30309496 | 0.83 | EGFR (0.46) | CDK4CDK6CCND3CCND1EGFR |
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-111377907-B | Polysubstituted phenylamino pyrimidine derivative and preparation method and application thereof | 杭州百新生物医药科技有限公司 | 2023-03-28 | — | — | CN | disclosed |