Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 16/20 | 0.71 |
| ▸ | CDK1 | P06493 | 15/20 | 0.71 |
| ▸ | CCNB1 | P14635 | 12/20 | 0.71 |
| ▸ | CCNE1 | P24864 | 12/20 | 0.71 |
| ▸ | CDK6 | Q00534 | 10/20 | 0.71 |
| ▸ | CCND3 | P30281 | 6/20 | 0.71 |
| ▸ | CCNT1 | O60563 | 2/20 | 0.71 |
| ▸ | CDK9 | P50750 | 2/20 | 0.71 |
| ▸ | CDK2 | P24941 | 7/20 | 0.70 |
| ▸ | CCNA2 | P20248 | 5/20 | 0.70 |
| ▸ | CCNE2 | O96020 | 3/20 | 0.70 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.70 |
| ▸ | EGFR | P00533 | 2/20 | 0.70 |
| ▸ | CCND1 | P24385 | 2/20 | 0.70 |
| ▸ | CIT | O14578 | 1/20 | 0.70 |
| ▸ | GAK | O14976 | 1/20 | 0.70 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.70 |
| ▸ | STK16 | O75716 | 1/20 | 0.70 |
| ▸ | CCNK | O75909 | 1/20 | 0.70 |
| ▸ | STK10 | O94804 | 1/20 | 0.70 |
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 | |
|---|---|---|---|---|
| SCHEMBL17489168 | 0.97 | CDK4 (0.72) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17477178 | 0.91 | CDK4 (0.69) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489251 | 0.90 | CDK4 (0.60) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17488745 | 0.90 | CDK4 (0.88) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489052 | 0.90 | CDK4 (0.88) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489050 | 0.90 | CDK4 (0.75) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489169 | 0.89 | CDK4 (0.71) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL30459527 | 0.89 | CDK4 (0.62) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489268 | 0.89 | CDK4 (0.62) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17488770 | 0.87 | CDK4 (0.64) | CDK4CDK1CCNB1CCNE1CDK6 |
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-2016015605-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |