Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.81 |
| ▸ | CCND1 | P24385 | 13/20 | 0.81 |
| ▸ | CCND3 | P30281 | 12/20 | 0.81 |
| ▸ | CCND2 | P30279 | 11/20 | 0.81 |
| ▸ | CDK6 | Q00534 | 8/20 | 0.76 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.76 |
| ▸ | CDK2 | P24941 | 2/20 | 0.76 |
| ▸ | CDK9 | P50750 | 2/20 | 0.76 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.76 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.76 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.76 |
| ▸ | CCNT2 | O60583 | 1/20 | 0.76 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.76 |
| ▸ | STK16 | O75716 | 1/20 | 0.76 |
| ▸ | CCNK | O75909 | 1/20 | 0.76 |
| ▸ | PDE5A | O76074 | 1/20 | 0.76 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.76 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.76 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.76 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.76 |
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 | |
|---|---|---|---|---|
| SCHEMBL17484290 | 0.98 | CDK4 (0.80) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17479298 | 0.97 | CDK4 (0.83) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17484240 | 0.93 | CDK4 (0.88) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17484294 | 0.93 | CDK4 (0.85) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17484239 | 0.93 | CDK4 (0.90) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17484245 | 0.93 | CDK4 (0.89) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17484269 | 0.92 | CDK4 (0.80) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL26298974 | 0.91 | CDK4 (0.90) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17479199 | 0.91 | CDK4 (0.90) | CDK4CCND1CCND3CCND2CDK6 | |
| SCHEMBL17479144 | 0.90 | CDK4 (0.90) | CDK4CCND1CCND3CCND2CDK6 |
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-2016015597-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |