Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.75 |
| ▸ | CDK6 | Q00534 | 16/20 | 0.75 |
| ▸ | CDK2 | P24941 | 14/20 | 0.75 |
| ▸ | CDK1 | P06493 | 11/20 | 0.75 |
| ▸ | CCNB1 | P14635 | 6/20 | 0.75 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.75 |
| ▸ | CCND3 | P30281 | 5/20 | 0.75 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.75 |
| ▸ | CDK7 | P50613 | 4/20 | 0.75 |
| ▸ | CDK9 | P50750 | 4/20 | 0.75 |
| ▸ | KDR | P35968 | 2/20 | 0.75 |
| ▸ | CIT | O14578 | 1/20 | 0.75 |
| ▸ | GAK | O14976 | 1/20 | 0.75 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.75 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.75 |
| ▸ | STK16 | O75716 | 1/20 | 0.75 |
| ▸ | CCNK | O75909 | 1/20 | 0.75 |
| ▸ | STK10 | O94804 | 1/20 | 0.75 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.75 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.75 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL19475288 | 1.00 | CDK4 (0.75) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL30459468 | 0.94 | CDK4 (0.84) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL30460094 | 0.94 | CDK4 (0.84) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL2490067 | 0.94 | CDK4 (0.84) | CDK4CDK6CDK2CDK1CCNB1 | |
| Trifluoroacetic Acid SCHEMBL30584528 | 0.90 | CDK4 (0.75) | CDK4CDK6CDK2CDK1CCNB1 | |
| Trifluoroacetic Acid SCHEMBL20838466 | 0.89 | CDK4 (0.74) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL22581106 | 0.89 | CDK4 (0.82) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL17488760 | 0.88 | CDK4 (0.88) | CDK4CDK6CDK2CDK1CCNB1 | |
| Trifluoroacetic Acid SCHEMBL29443175 | 0.87 | CDK4 (0.63) | CDK4CDK6CDK2CDK1CCNB1 | |
| SCHEMBL21658739 | 0.87 | CDK4 (0.87) | CDK4CDK6CDK2CDK1CCNB1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109071552-B | Degradation of cyclin dependent kinase 4/6(CDK4/6) by conjugation of CDK4/6 inhibitors to E3 ligase ligands and methods of use | 达纳－法伯癌症研究所公司 | 2022-06-03 | — | — | CN | disclosed |