Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.49 |
| ▸ | KCNN3 | Q9UGI6 | 7/20 | 0.39 |
| ▸ | CCNT1 | O60563 | 11/20 | 0.38 |
| ▸ | CDK9 | P50750 | 11/20 | 0.38 |
| ▸ | KCNN1 | Q92952 | 1/20 | 0.36 |
| ▸ | KCNN2 | Q9H2S1 | 1/20 | 0.36 |
| ▸ | CDK7 | P50613 | 3/20 | 0.35 |
| ▸ | CCNH | P51946 | 3/20 | 0.35 |
| ▸ | CDK4 | P11802 | 2/20 | 0.35 |
| ▸ | CCND1 | P24385 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12953629 | 0.87 | PDE10A (0.47) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL12953173 | 0.80 | PDE10A (0.54) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL21877657 | 0.79 | PDE10A (0.56) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL31465470 | 0.73 | PDE10A (0.61) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL26870870 | 0.72 | PDE10A (0.51) | PDE10ACCNT1CDK9CDK7CCNH | |
| SCHEMBL26871014 | 0.72 | PDE10A (0.51) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL26871265 | 0.71 | PDE10A (0.50) | PDE10AKCNN3CCNT1CDK9CDK7 | |
| SCHEMBL12978823 | 0.71 | PDE10A (0.47) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL12953048 | 0.71 | PDE10A (0.57) | PDE10AKCNN3CCNT1CDK9KCNN1 | |
| SCHEMBL14050765 | 0.70 | CCNT1 (0.53) | PDE10ACCNT1CDK9CDK7CCNH |
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-1931677-B1 | NOVEL PYRAZOLOPYRIMIDINES AS CYCLIN DEPENDENT KINASE INHIBITORS | MERCK SHARP & DOHME (US) | 2016-04-20 | — | — | EP | disclosed |