Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK1 | P06493 | 19/20 | 1.00 |
| ▸ | PRKCA | P17252 | 1/20 | 0.77 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.65 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.60 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.60 |
| ▸ | GSK3B | P49841 | 1/20 | 0.60 |
| ▸ | MERTK | Q12866 | 1/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL3691933 | 0.89 | CDK1 (1.00) | CDK1CDK5 | |
| SCHEMBL3691935 | 0.89 | CDK1 (1.00) | CDK1CDK5 | |
| SCHEMBL13046778 | 0.89 | CDK1 (1.00) | CDK1PRKCACDK5 | |
| SCHEMBL8712285 | 0.87 | CDK1 (1.00) | CDK1PRKCACDK5CCNB1EIF2AK2 | |
| SCHEMBL5839899 | 0.87 | CDK1 (1.00) | CDK1PRKCACDK5CCNB1EIF2AK2 | |
| SCHEMBL8706366 | 0.84 | CDK1 (1.00) | CDK1PRKCACDK5CCNB1EIF2AK2 | |
| SCHEMBL20549707 | 0.82 | CDK1 (0.70) | CDK1PRKCACDK5 | |
| SCHEMBL13046771 | 0.81 | CDK1 (1.00) | CDK1CDK5 | |
| SCHEMBL5839629 | 0.80 | CDK1 (1.00) | CDK1PRKCACDK5CCNB1EIF2AK2 | |
| SCHEMBL5839639 | 0.80 | CDK1 (1.00) | CDK1PRKCACDK5CCNB1EIF2AK2 |
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-2010136705-A1 | PHARMACEUTICAL ANTITUMOR COMPOSITION INCLUDING A CDK INHIBITOR AND A CELL-GROWTH INHIBITOR | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2010-12-02 | — | — | WO | disclosed |