Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 20/20 | 0.82 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL14720951 | 1.00 | PDE10A (0.82) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL15945392 | 1.00 | PDE10A (0.82) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14721189 | 0.90 | PDE10A (0.84) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14722815 | 0.90 | PDE10A (0.84) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14723429 | 0.90 | PDE10A (1.00) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14723037 | 0.90 | PDE10A (1.00) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14721277 | 0.90 | PDE10A (1.00) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14726822 | 0.90 | PDE10A (1.00) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14726816 | 0.88 | PDE10A (0.80) | PDE10ASSTR2KCNH2NR1I2CYP2C9 | |
| SCHEMBL14722970 | 0.88 | PDE10A (0.80) | PDE10ASSTR2KCNH2NR1I2CYP2C9 |
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-2013028590-A1 | PYRIMIDINE PDE10 INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2013-02-28 | — | — | WO | disclosed |