Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 14/20 | 0.44 |
| ▸ | CCNA2 | P20248 | 14/20 | 0.44 |
| ▸ | CCND1 | P24385 | 14/20 | 0.44 |
| ▸ | CDK2 | P24941 | 14/20 | 0.44 |
| ▸ | CCND3 | P30281 | 14/20 | 0.44 |
| ▸ | CDK6 | Q00534 | 14/20 | 0.44 |
| ▸ | CDK7 | P50613 | 9/20 | 0.44 |
| ▸ | CCNH | P51946 | 9/20 | 0.44 |
| ▸ | CCNT1 | O60563 | 8/20 | 0.44 |
| ▸ | CDK9 | P50750 | 8/20 | 0.44 |
| ▸ | CDK1 | P06493 | 7/20 | 0.44 |
| ▸ | CCNB1 | P14635 | 7/20 | 0.44 |
| ▸ | RORC | P51449 | 6/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29754964 | 0.86 | CDK2 (0.49) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676002 | 0.86 | CDK2 (0.49) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676473 | 0.85 | RORC (0.35) | CCNT1RORC | |
| SCHEMBL24676697 | 0.80 | RORC (0.37) | CCNT1RORC | |
| SCHEMBL24676950 | 0.78 | TDO2 (0.42) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676481 | 0.76 | CCND1 (0.40) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676461 | 0.73 | CDK2 (0.59) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676824 | 0.71 | TDO2 (0.43) | CDK4CCNA2CCND1CDK2CCND3 | |
| SCHEMBL24676472 | 0.71 | TDO2 (0.42) | CDK4CCND1CDK2CCND3CDK6 | |
| SCHEMBL29754809 | 0.70 | GPR119 (0.42) | CDK4CCNA2CCND1CDK2CCND3 |
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 |