Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 18/20 | 0.69 |
| ▸ | GRM3 | Q14832 | 5/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL9940841 | 0.93 | GRM5 (0.73) | GRM5GRM3CYP1A2 | |
| SCHEMBL9938835 | 0.90 | GRM5 (0.67) | GRM5GRM3CYP1A2 | |
| SCHEMBL9937701 | 0.90 | GRM5 (0.67) | GRM5GRM3CYP1A2 | |
| SCHEMBL9940815 | 0.90 | GRM5 (0.69) | GRM5GRM3CYP1A2 | |
| SCHEMBL9941515 | 0.89 | GRM5 (0.70) | GRM5GRM3CYP1A2 | |
| SCHEMBL9938020 | 0.88 | GRM5 (0.72) | GRM5GRM3CYP1A2 | |
| SCHEMBL9937996 | 0.88 | GRM5 (0.72) | GRM5GRM3CYP1A2 | |
| SCHEMBL9937735 | 0.88 | GRM5 (0.72) | GRM5GRM3CYP1A2 | |
| SCHEMBL9937298 | 0.87 | GRM5 (0.63) | GRM5GRM3 | |
| SCHEMBL9937686 | 0.87 | GRM5 (0.68) | GRM5GRM3CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2651222-A1 | BICYCLIC TRIAZOLE AND PYRAZOLE LACTAMS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | Vanderbilt University (US) | 2013-10-23 | — | — | EP | disclosed |
| WO-2012083224-A1 | BICYCLIC TRIAZOLE AND PYRAZOLE LACTAMS AS ALLOSTERIC MODULATORS OF MGLUR5 RECEPTORS | VANDERBILT UNIVERSITY (US) | 2012-06-21 | — | — | WO | disclosed |