Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 13/20 | 0.37 |
| ▸ | CDK9 | P50750 | 11/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 10/20 | 0.37 |
| ▸ | CDK4 | P11802 | 8/20 | 0.37 |
| ▸ | CCND1 | P24385 | 8/20 | 0.37 |
| ▸ | CDK7 | P50613 | 7/20 | 0.37 |
| ▸ | CCNA2 | P20248 | 7/20 | 0.37 |
| ▸ | CCND3 | P30281 | 7/20 | 0.37 |
| ▸ | CDK6 | Q00534 | 7/20 | 0.37 |
| ▸ | CCNH | P51946 | 6/20 | 0.37 |
| ▸ | CDK1 | P06493 | 4/20 | 0.37 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.37 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.37 |
| ▸ | CCNK | O75909 | 6/20 | 0.35 |
| ▸ | CDK12 | Q9NYV4 | 6/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.35 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.34 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.34 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29754815 | 1.00 | CDK2 (0.37) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL24676943 | 0.89 | CDK9 (0.33) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL29754894 | 0.89 | CDK9 (0.33) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL24676684 | 0.85 | CDK2 (0.43) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL24676566 | 0.84 | CCNE1 (0.45) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL29754806 | 0.84 | CDK2 (0.54) | CDK2CDK4CCND1CCNA2CCND3 | |
| SCHEMBL24676105 | 0.84 | CDK2 (0.36) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL24676765 | 0.84 | CDK2 (0.54) | CDK2CDK4CCND1CCNA2CCND3 | |
| SCHEMBL24676764 | 0.84 | CDK2 (0.36) | CDK2CDK9CCNT1CDK4CCND1 | |
| SCHEMBL24676103 | 0.83 | CCNE1 (0.47) | CDK2CDK9CCNT1CDK4CCND1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022155941-A1 | CDK2 INHIBITORS | QILU REGOR THERAPEUTICS INC. (CN) | 2022-07-28 | — | — | WO | disclosed |