Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 2/20 | 0.47 |
| ▸ | PDE4A | P27815 | 2/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.47 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.47 |
| ▸ | PDE10A | Q9Y233 | 5/20 | 0.46 |
| ▸ | CCNE1 | P24864 | 5/20 | 0.39 |
| ▸ | CDK2 | P24941 | 5/20 | 0.39 |
| ▸ | PRKD1 | Q15139 | 2/20 | 0.39 |
| ▸ | PRKD2 | Q9BZL6 | 2/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 2/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.37 |
| ▸ | DNM1L | O00429 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2021521 | 0.84 | PDE10A (0.45) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3236327 | 0.84 | CHRM3 (0.47) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3236457 | 0.80 | MAPK1 (0.37) | CCNE1CDK2PIK3CA | |
| SCHEMBL2021524 | 0.79 | PDE10A (0.46) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL2021429 | 0.72 | NUDT1 (0.46) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL3242401 | 0.72 | CYP1A2 (0.37) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL2020318 | 0.70 | PDE10A (0.71) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL18176142 | 0.68 | PDE10A (0.49) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL23299933 | 0.67 | PDE10A (0.48) | CHRM3PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL23275242 | 0.67 | PIK3CA (0.48) | CHRM3PDE4APDE4BPDE4CPDE4D |
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-2010027097-A1 | TRI-SUBSTITUTED PYRIMIDINE COMPOUNDS AND THEIR USE AS PDE10 INHIBITORS | MITSUBISHI TANABE PHARMA CORPORATION (JP) | 2010-03-11 | — | — | WO | disclosed |