Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 17/20 | 0.53 |
| ▸ | CCNE1 | P24864 | 11/20 | 0.53 |
| ▸ | CCND1 | P24385 | 7/20 | 0.49 |
| ▸ | CDK6 | Q00534 | 7/20 | 0.49 |
| ▸ | CDK1 | P06493 | 7/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.49 |
| ▸ | CCNT1 | O60563 | 5/20 | 0.49 |
| ▸ | CDK4 | P11802 | 5/20 | 0.49 |
| ▸ | CCND3 | P30281 | 5/20 | 0.49 |
| ▸ | CDK7 | P50613 | 5/20 | 0.49 |
| ▸ | CDK9 | P50750 | 5/20 | 0.49 |
| ▸ | CCNH | P51946 | 5/20 | 0.49 |
| ▸ | MNAT1 | P51948 | 5/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 6/20 | 0.47 |
| ▸ | CCNK | O75909 | 2/20 | 0.47 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.47 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.44 |
| ▸ | CCNE2 | O96020 | 2/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.44 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL26918782 | 1.00 | CDK2 (0.53) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL24477596 | 0.99 | CDK2 (0.52) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942298 | 0.91 | CDK2 (0.48) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942362 | 0.91 | CDK2 (0.48) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942726 | 0.90 | CDK2 (0.47) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942172 | 0.90 | CDK2 (0.47) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942110 | 0.89 | CDK2 (0.51) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942111 | 0.89 | CDK2 (0.51) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942077 | 0.89 | CDK2 (0.51) | CDK2CCNE1CCND1CDK6CDK1 | |
| SCHEMBL26942215 | 0.88 | CDK2 (0.51) | CDK2CCNE1CCND1CDK6CDK1 |
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-116472270-A | CDK inhibitors | 上海齐鲁制药研究中心有限公司 | 2023-07-21 | — | — | CN | disclosed |
| WO-2022166793-A1 | CDK INHIBITOR | 上海齐鲁制药研究中心有限公司 | 2022-08-11 | — | — | WO | disclosed |