Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 20/20 | 1.00 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL6922882 | 0.83 | GRM4 (0.71) | GRM4 | |
| SCHEMBL2361230 | 0.78 | GRM4 (1.00) | GRM4 | |
| SCHEMBL2361015 | 0.78 | GRM4 (1.00) | GRM4 | |
| SCHEMBL2360915 | 0.77 | GRM4 (1.00) | GRM4 | |
| SCHEMBL19801443 | 0.76 | GRM4 (0.66) | GRM4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL19794608 | 0.75 | GRM4 (0.63) | GRM4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6922873 | 0.74 | GRM4 (1.00) | GRM4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL2359983 | 0.74 | GRM4 (1.00) | GRM4 | |
| SCHEMBL19794746 | 0.74 | GRM4 (1.00) | GRM4CYP1A2CYP3A4CYP2D6CYP2C9 | |
| SCHEMBL6922917 | 0.73 | GRM4 (1.00) | GRM4 |
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-2011100607-A1 | PYRAZOLOPYRIDINE, PYRAZOLOPYRAZINE, PYRAZOLOPYRIMIDINE, PYRAZOLOTHIOPHENE AND PYRAZOLOTHIAZOLE COMPOUNDS AS MGLUR4 ALLOSTERIC POTENTIATORS, COMPOUNDS, AND METHODS OF TREATING NEUROLOGICAL DYSFUNCTION | VANDERBILT UNIVERSITY (US) | 2011-08-18 | — | — | WO | disclosed |