Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.76 |
| ▸ | CDK6 | Q00534 | 20/20 | 0.76 |
| ▸ | CDK2 | P24941 | 18/20 | 0.76 |
| ▸ | CDK1 | P06493 | 5/20 | 0.76 |
| ▸ | CDK7 | P50613 | 5/20 | 0.76 |
| ▸ | CDK9 | P50750 | 5/20 | 0.76 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.69 |
| ▸ | CCND3 | P30281 | 1/20 | 0.67 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.65 |
| ▸ | CSF1R | P07333 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL20356411 | 0.89 | CDK4 (0.66) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL17477259 | 0.86 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19966557 | 0.86 | CDK4 (0.72) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL24632976 | 0.85 | CDK4 (0.80) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089021 | 0.83 | CDK4 (1.00) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19966508 | 0.83 | CDK4 (0.77) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19089240 | 0.83 | CDK4 (0.87) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL19966517 | 0.82 | CDK4 (0.82) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL29591465 | 0.82 | CDK4 (0.70) | CDK4CDK6CDK2CDK1CDK7 | |
| SCHEMBL20356412 | 0.82 | CDK4 (0.70) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108264512-B | Nitrogen-containing fused heterocyclic compound, preparation method, intermediate, composition and application thereof | 上海医药集团股份有限公司 | 2022-05-03 | — | — | CN | disclosed |
| WO-2018121766-A1 | NITROGEN-CONTAINING FUSED HETEROCYCLIC COMPOUND, PREPARATION METHOD THEREFOR, AND INTERMEDIATE, COMPOSITION, AND APPLICATION THEREOF | 上海医药集团股份有限公司 | 2018-07-05 | — | — | WO | disclosed |