Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 20/20 | 0.68 |
| ▸ | CDK1 | P06493 | 14/20 | 0.68 |
| ▸ | CCNB1 | P14635 | 9/20 | 0.68 |
| ▸ | CCNE1 | P24864 | 9/20 | 0.68 |
| ▸ | CDK6 | Q00534 | 13/20 | 0.65 |
| ▸ | CDK9 | P50750 | 6/20 | 0.65 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.65 |
| ▸ | CCND3 | P30281 | 1/20 | 0.65 |
| ▸ | CDK2 | P24941 | 12/20 | 0.61 |
| ▸ | CDK7 | P50613 | 5/20 | 0.60 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL17485337 | 0.93 | CDK4 (0.79) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17485332 | 0.90 | CDK4 (0.66) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL18288525 | 0.89 | CDK4 (0.87) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL19089441 | 0.84 | CDK4 (0.82) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17485372 | 0.84 | CDK4 (0.79) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17489251 | 0.83 | CDK4 (0.60) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17485349 | 0.82 | CDK4 (0.61) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL18288933 | 0.81 | CDK4 (1.00) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17485353 | 0.81 | CDK4 (0.63) | CDK4CDK1CCNB1CCNE1CDK6 | |
| SCHEMBL17485406 | 0.81 | CDK4 (0.79) | CDK4CDK1CCNB1CCNE1CDK6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |
| WO-2016015604-A1 | COMPOUNDS AS CDK SMALL-MOLECULE INHIBITORS AND USES THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2016-02-04 | — | — | WO | disclosed |