Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 12/20 | 0.50 |
| ▸ | AURKA | O14965 | 9/20 | 0.50 |
| ▸ | CCNA2 | P20248 | 11/20 | 0.47 |
| ▸ | CCNA1 | P78396 | 10/20 | 0.47 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
| ▸ | CCND3 | P30281 | 2/20 | 0.44 |
| ▸ | CDK6 | Q00534 | 2/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | TTK | P33981 | 2/20 | 0.40 |
| ▸ | PLK1 | P53350 | 1/20 | 0.40 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.38 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.38 |
| ▸ | CACNA1H | O95180 | 1/20 | 0.38 |
| ▸ | CACNA1I | Q9P0X4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9940604 | 0.88 | CDK2 (0.48) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL10219366 | 0.80 | NAMPT (0.38) | CDK2AURKAHDAC1HDAC6 | |
| SCHEMBL9941217 | 0.78 | CDK2 (0.48) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL11026206 | 0.74 | CDK2 (0.54) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL9940538 | 0.74 | CDK2 (0.48) | CDK2AURKACCNA2CCNA1CDK4 | |
| Trifluoroacetic Acid SCHEMBL9941222 | 0.73 | CDK2 (0.47) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL9941063 | 0.72 | CDK2 (0.46) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL9940669 | 0.70 | CDK2 (0.41) | CDK2AURKACCNA2CCNA1CDK4 | |
| SCHEMBL11024059 | 0.69 | MAPKAPK2 (0.47) | CDK2AURKACCNA2CCNA1HDAC1 | |
| SCHEMBL12698346 | 0.69 | CDK2 (0.48) | CDK2AURKACCNA2CCNA1CDK4 |
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-2614065-B1 | SUBSTITUTED PYRAZOLO-QUINAZOLINE DERIVATIVES AS KINASE INHIBITORS | NERVIANO MEDICAL SCIENCES SRL (IT) | 2017-04-19 | — | — | EP | disclosed |