Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 16/20 | 0.43 |
| ▸ | CDK9 | P50750 | 8/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 12/20 | 0.43 |
| ▸ | CDK7 | P50613 | 11/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 8/20 | 0.43 |
| ▸ | CCNH | P51946 | 8/20 | 0.43 |
| ▸ | CCNT1 | O60563 | 3/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.43 |
| ▸ | CDK1 | P06493 | 12/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 8/20 | 0.42 |
| ▸ | CDK4 | P11802 | 7/20 | 0.42 |
| ▸ | CCND1 | P24385 | 7/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 2/20 | 0.42 |
| ▸ | CCNK | O75909 | 2/20 | 0.41 |
| ▸ | CDK12 | Q9NYV4 | 2/20 | 0.41 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.41 |
| ▸ | CLK2 | P49760 | 2/20 | 0.41 |
| ▸ | CSNK1G2 | P78368 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL23992724 | 0.89 | CDK1 (0.57) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL19112198 | 0.89 | CDK1 (0.57) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL22651959 | 0.89 | CDK1 (0.57) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL19111920 | 0.82 | CDK1 (0.46) | CDK2CCNE1CDK5CDK1CCNB1 | |
| SCHEMBL19112167 | 0.79 | CCNE1 (0.53) | CDK2CDK9CCNE1CCNT1CDK1 | |
| SCHEMBL23992703 | 0.79 | CDK1 (0.57) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL23752348 | 0.78 | CDK1 (0.67) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL29684386 | 0.78 | CDK1 (0.67) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL19111944 | 0.78 | CDK1 (0.67) | CDK2CDK9CCNE1CDK7CDK5 | |
| SCHEMBL23961653 | 0.78 | CDK2 (0.69) | CDK2CDK9CCNE1CDK7CDK5 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2664619-B1 | Purine derivatives as tools for screening anti-Alzheimer compounds | MANROS THERAPEUTICS (FR) | 2017-07-12 | — | — | EP | disclosed |