Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.83 |
| ▸ | CDK1 | P06493 | 10/20 | 0.83 |
| ▸ | CCNE1 | P24864 | 4/20 | 0.83 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.83 |
| ▸ | CDK2 | P24941 | 16/20 | 0.82 |
| ▸ | CDK6 | Q00534 | 16/20 | 0.82 |
| ▸ | CDK7 | P50613 | 7/20 | 0.80 |
| ▸ | CDK9 | P50750 | 7/20 | 0.80 |
| ▸ | CDK5 | Q00535 | 7/20 | 0.80 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.78 |
| ▸ | CCND3 | P30281 | 3/20 | 0.78 |
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 | |
|---|---|---|---|---|
| SCHEMBL18288763 | 0.99 | CDK4 (0.83) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL18289054 | 0.93 | CDK4 (0.74) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL18288772 | 0.91 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL19088974 | 0.90 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL19089015 | 0.90 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL18288852 | 0.90 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL22010592 | 0.90 | CDK4 (0.86) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL18288909 | 0.89 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL19089020 | 0.89 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 | |
| SCHEMBL19088980 | 0.89 | CDK4 (1.00) | CDK4CDK1CCNE1CCNB1CDK2 |
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-2016192630-A1 | COMPOUND HAVING KINASE INHIBITING ACTIVITY, METHOD OF PREPARING SAME, AND USE OF SAME | 中国科学院上海药物研究所 | 2016-12-08 | — | — | WO | disclosed |