Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.82 |
| ▸ | CDK6 | Q00534 | 20/20 | 0.82 |
| ▸ | CDK2 | P24941 | 17/20 | 0.82 |
| ▸ | CDK1 | P06493 | 5/20 | 0.78 |
| ▸ | CDK7 | P50613 | 5/20 | 0.78 |
| ▸ | CDK9 | P50750 | 5/20 | 0.78 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.78 |
| ▸ | CCND3 | P30281 | 2/20 | 0.69 |
| ▸ | CSF1R | P07333 | 1/20 | 0.58 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL19089021 | 0.90 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089007 | 0.88 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089163 | 0.88 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL17477259 | 0.88 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089042 | 0.87 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089236 | 0.86 | CDK4 (0.85) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089204 | 0.86 | CDK4 (0.85) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19088967 | 0.86 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089235 | 0.86 | CDK4 (0.85) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19088965 | 0.86 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 |
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-2018045957-A1 | CDK4/6 INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 江苏豪森药业集团有限公司 | 2018-03-15 | — | — | WO | disclosed |