Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 19/20 | 0.67 |
| ▸ | CDK1 | P06493 | 12/20 | 0.67 |
| ▸ | CCNE1 | P24864 | 12/20 | 0.67 |
| ▸ | CCNE2 | O96020 | 6/20 | 0.67 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.67 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.67 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.67 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.67 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.67 |
| ▸ | CDK4 | P11802 | 10/20 | 0.54 |
| ▸ | CCND1 | P24385 | 10/20 | 0.54 |
| ▸ | CDK6 | Q00534 | 4/20 | 0.49 |
| ▸ | CASK | O14936 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | CDKL5 | O76039 | 1/20 | 0.49 |
| ▸ | STK10 | O94804 | 1/20 | 0.49 |
| ▸ | CDK14 | O94921 | 1/20 | 0.49 |
| ▸ | ABL1 | P00519 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | MAK | P20794 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29236029 | 1.00 | CDK2 (0.67) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL29235878 | 0.90 | CDK2 (0.65) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL30838835 | 0.90 | CDK2 (0.65) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL29235988 | 0.89 | CDK2 (0.64) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL30838846 | 0.89 | CDK2 (0.64) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL29235902 | 0.85 | CDK2 (0.54) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL30838853 | 0.85 | CDK2 (0.54) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL29235997 | 0.85 | CDK2 (0.66) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL30838823 | 0.85 | CDK2 (0.66) | CDK2CDK1CCNE1CCNE2CCNB1 | |
| SCHEMBL29236014 | 0.85 | CDK2 (0.61) | CDK2CDK1CCNE1CCNE2CCNB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118005614-B | Pyrimidine pyridine CDK inhibitor and preparation method and application thereof | 中国药科大学 | 2025-02-07 | — | — | CN | disclosed |
| CN-118005614-A | Pyrimidine pyridine CDK inhibitor and preparation method and application thereof | 中国药科大学 | 2024-05-10 | — | — | CN | disclosed |