Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 19/20 | 0.58 |
| ▸ | CDK5 | Q00535 | 15/20 | 0.58 |
| ▸ | DYRK1A | Q13627 | 14/20 | 0.58 |
| ▸ | CCNA2 | P20248 | 13/20 | 0.58 |
| ▸ | CCNA1 | P78396 | 13/20 | 0.58 |
| ▸ | CDK5R1 | Q15078 | 13/20 | 0.58 |
| ▸ | CDK1 | P06493 | 7/20 | 0.58 |
| ▸ | CCNE1 | P24864 | 6/20 | 0.58 |
| ▸ | CCNB1 | P14635 | 5/20 | 0.58 |
| ▸ | CDK7 | P50613 | 4/20 | 0.54 |
| ▸ | CDK9 | P50750 | 3/20 | 0.54 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.54 |
| ▸ | CLK2 | P49760 | 2/20 | 0.54 |
| ▸ | CSNK1G2 | P78368 | 2/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.54 |
| ▸ | CSNK1G1 | Q9HCP0 | 2/20 | 0.54 |
| ▸ | CCNB2 | O95067 | 2/20 | 0.54 |
| ▸ | CDK4 | P11802 | 2/20 | 0.54 |
| ▸ | CCND1 | P24385 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL23992746 | 0.85 | CDK2 (0.47) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL23992749 | 0.85 | CDK2 (0.42) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL18697927 | 0.83 | CDK2 (0.48) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL18511090 | 0.78 | CDK1 (0.55) | CDK2CDK5DYRK1ACDK5R1CDK1 | |
| SCHEMBL16683658 | 0.77 | CDK2 (0.45) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL14327305 | 0.77 | CDK2 (0.44) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL19112199 | 0.75 | CCNK (0.74) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL23992716 | 0.74 | CDK2 (0.61) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL6747330 | 0.73 | CDK5 (0.46) | CDK2CDK5DYRK1ACCNA2CCNA1 | |
| SCHEMBL22651813 | 0.73 | CDK5 (0.83) | CDK2CDK5DYRK1ACCNA2CCNA1 |
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-3901154-A1 | PURINE DERIVATIVES AS DRUGS FOR THE TREATMENT OF NEONATAL HYPOXIA-ISCHEMIA BRAIN INJURY AND RELATED DISEASES | Commissariat à l'énergie atomique et aux énergies alternatives (FR) | 2021-10-27 | — | — | EP | disclosed |