Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 16/20 | 0.39 |
| ▸ | CDK6 | Q00534 | 11/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.39 |
| ▸ | CCND1 | P24385 | 1/20 | 0.39 |
| ▸ | CCND3 | P30281 | 1/20 | 0.39 |
| ▸ | PLK4 | O00444 | 4/20 | 0.38 |
| ▸ | CDK1 | P06493 | 12/20 | 0.38 |
| ▸ | CDK7 | P50613 | 2/20 | 0.37 |
| ▸ | CDK9 | P50750 | 2/20 | 0.37 |
| ▸ | TBK1 | Q9UHD2 | 1/20 | 0.36 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.35 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL31434392 | 1.00 | CDK4 (0.39) | CDK4CDK6CDK2CCND1CCND3 | |
| SCHEMBL20311307 | 0.80 | PLK4 (0.41) | CDK4CDK6CDK2CCND3PLK4 | |
| SCHEMBL26542499 | 0.77 | PLK4 (0.40) | CDK4CDK6CDK2PLK4CDK1 | |
| SCHEMBL30309559 | 0.77 | PLK4 (0.40) | CDK4CDK6CDK2PLK4CDK1 | |
| SCHEMBL2490112 | 0.77 | PLK4 (0.40) | CDK4CDK6CDK2PLK4CDK1 | |
| SCHEMBL21391030 | 0.77 | CDK4 (0.40) | CDK4CDK6CDK2CCND1CCND3 | |
| Hydrochloric Acid SCHEMBL31686442 | 0.76 | PLK4 (0.39) | CDK4CDK6CDK2PLK4CDK1 | |
| SCHEMBL21454993 | 0.75 | PLK4 (0.39) | CDK4CDK6CDK2CCND1CCND3 | |
| SCHEMBL25632720 | 0.75 | CDK4 (0.42) | CDK4CDK6CDK2CCND1CCND3 | |
| SCHEMBL30039587 | 0.73 | CDK4 (0.51) | CDK4CDK6CDK2CCND1CCND3 |
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-110218189-B | Abelide intermediate and simple preparation method of Abelide | 新发药业有限公司 | 2020-10-30 | — | — | CN | disclosed |