Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 20/20 | 0.59 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL19751941 | 0.82 | PDE10A (0.59) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751927 | 0.79 | PDE10A (0.63) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751837 | 0.77 | PDE10A (0.65) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751914 | 0.75 | PDE10A (0.44) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751830 | 0.75 | PDE10A (0.58) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751924 | 0.74 | PDE10A (0.72) | PDE10ANR1I2CYP3A4 | |
| SCHEMBL19751827 | 0.65 | PDE10A (0.66) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751939 | 0.62 | PDE10A (0.66) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL19751942 | 0.61 | PDE10A (0.51) | PDE10ANR1I2CYP3A4CYP2C9 | |
| SCHEMBL17837651 | 0.59 | ALDH1A1 (0.35) | — |
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-2621276-B1 | 2-ALKOXY PYRIMIDINE PDE10 INHIBITORS | MERCK SHARP & DOHME (US) | 2017-12-27 | — | — | EP | disclosed |