Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK6 | Q00534 | 12/20 | 0.58 |
| ▸ | CDK2 | P24941 | 9/20 | 0.55 |
| ▸ | CDK1 | P06493 | 9/20 | 0.55 |
| ▸ | PIM1 | P11309 | 1/20 | 0.51 |
| ▸ | CDK4 | P11802 | 12/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.51 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.51 |
| ▸ | CDK9 | P50750 | 4/20 | 0.51 |
| ▸ | CDK7 | P50613 | 3/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | DYRK2 | Q92630 | 2/20 | 0.50 |
| ▸ | CCND1 | P24385 | 1/20 | 0.50 |
| ▸ | CCND3 | P30281 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL19968032 | 0.90 | CDK4 (0.63) | CDK6CDK2CDK1CDK4CCNB1 | |
| SCHEMBL19968106 | 0.87 | CDK6 (0.51) | CDK6CDK2CDK1PIM1CDK4 | |
| SCHEMBL19968053 | 0.87 | CDK6 (0.52) | CDK6CDK2CDK1PIM1CDK4 | |
| SCHEMBL30789752 | 0.87 | CDK6 (0.52) | CDK6CDK2CDK1PIM1CDK4 | |
| SCHEMBL19968038 | 0.84 | CDK4 (0.64) | CDK6CDK2CDK1CDK4CCNB1 | |
| SCHEMBL19968108 | 0.84 | CDK6 (0.51) | CDK6CDK2CDK1PIM1CDK4 | |
| SCHEMBL17488982 | 0.83 | CDK6 (0.69) | CDK6PIM1DYRK2CCND1 | |
| SCHEMBL19968040 | 0.81 | CDK4 (0.66) | CDK6CDK2CDK1PIM1CDK4 | |
| SCHEMBL17489295 | 0.81 | CDK6 (0.79) | CDK6PIM1DYRK2CCND1 | |
| SCHEMBL19968116 | 0.80 | CDK4 (0.64) | CDK6CDK2CDK1PIM1CDK4 |
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 |