Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 14/20 | 0.52 |
| ▸ | CDK4 | P11802 | 14/20 | 0.52 |
| ▸ | CCND1 | P24385 | 1/20 | 0.52 |
| ▸ | CCND3 | P30281 | 1/20 | 0.52 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | PIM1 | P11309 | 1/20 | 0.49 |
| ▸ | CDK1 | P06493 | 5/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.49 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.49 |
| ▸ | CDK2 | P24941 | 10/20 | 0.49 |
| ▸ | DYRK2 | Q92630 | 3/20 | 0.48 |
| ▸ | CDK9 | P50750 | 3/20 | 0.47 |
| ▸ | CDK7 | P50613 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30789752 | 1.00 | CDK6 (0.52) | CDK6CDK4CCND1CCND3HDAC1 | |
| SCHEMBL19968106 | 0.97 | CDK6 (0.51) | CDK6CDK4CCND1CCND3HDAC1 | |
| SCHEMBL19968108 | 0.95 | CDK6 (0.51) | CDK6CDK4CCND1CCND3HDAC1 | |
| SCHEMBL30926189 | 0.90 | CDK4 (0.61) | CDK6CDK4CDK1CCNB1CCNE1 | |
| SCHEMBL19968031 | 0.90 | CDK4 (0.61) | CDK6CDK4CDK1CCNB1CCNE1 | |
| SCHEMBL19967978 | 0.87 | CDK4 (0.60) | CDK6CDK4CDK1CCNB1CCNE1 | |
| SCHEMBL19968061 | 0.87 | CDK4 (0.60) | CDK6CDK4CDK1CCNB1CCNE1 | |
| SCHEMBL19968024 | 0.87 | CDK6 (0.58) | CDK6CDK4CCND1CCND3HDAC1 | |
| SCHEMBL19968047 | 0.87 | CDK4 (0.59) | CDK6CDK4CDK1CCNB1CCNE1 | |
| SCHEMBL19968130 | 0.87 | CDK4 (0.66) | CDK6CDK4CDK1CCNB1CCNE1 |
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-2018045956-A1 | BENZIMIDAZOLE COMPOUND KINASE INHIBITOR, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 江苏豪森药业集团有限公司 | 2018-03-15 | — | — | WO | disclosed |