Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 10/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.49 |
| ▸ | CDK1 | P06493 | 5/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.49 |
| ▸ | CDK9 | P50750 | 5/20 | 0.49 |
| ▸ | CCNE2 | O96020 | 4/20 | 0.49 |
| ▸ | CCNB2 | O95067 | 3/20 | 0.49 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.49 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.49 |
| ▸ | CCNB3 | Q8WWL7 | 3/20 | 0.49 |
| ▸ | JAK2 | O60674 | 2/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | AXL | P30530 | 1/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 4/20 | 0.42 |
| ▸ | CCND3 | P30281 | 2/20 | 0.42 |
| ▸ | CDK6 | Q00534 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | IGF1R | P08069 | 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 | |
|---|---|---|---|---|
| SCHEMBL29250067 | 1.00 | CDK2 (0.49) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL30237260 | 0.87 | CDK2 (0.46) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL29250163 | 0.87 | CDK2 (0.46) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL30237057 | 0.84 | CDK2 (0.43) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL29250118 | 0.84 | CDK2 (0.43) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL30237004 | 0.83 | CDK2 (0.44) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL29250102 | 0.83 | CDK2 (0.44) | CDK2CCNE1CDK1CCNB1CCNT1 | |
| SCHEMBL30237272 | 0.79 | DYRK1A (0.62) | CDK2CCNE1CDK1CDK9JAK2 | |
| SCHEMBL29250063 | 0.79 | DYRK1A (0.62) | CDK2CCNE1CDK1CDK9JAK2 | |
| SCHEMBL654899 | 0.72 | AURKA (0.69) | CDK2CDK1CDK5JAK2AXL |
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-115703760-B | 2, 4-Disubstituted pyrimidine cyclin dependent kinase enzyme inhibitor and preparation method and application thereof | 山东大学 | 2024-05-31 | — | — | CN | disclosed |
| CN-115703760-A | 2,4-disubstituted pyrimidines cyclin dependent kinase inhibitor and preparation method and application thereof | 山东大学 | 2023-02-17 | — | — | CN | disclosed |