Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 15/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.58 |
| ▸ | GRM3 | Q14832 | 4/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9936866 | 0.89 | GRM5 (0.61) | GRM5CYP1A2GRM3 | |
| SCHEMBL9941272 | 0.85 | CYP1A2 (0.61) | GRM5CYP1A2GRM3 | |
| SCHEMBL9938444 | 0.83 | GRM5 (0.63) | GRM5CYP1A2GRM3 | |
| SCHEMBL9938803 | 0.81 | GRM5 (0.60) | GRM5CYP1A2GRM3 | |
| SCHEMBL9938986 | 0.80 | GRM5 (0.60) | GRM5CYP1A2GRM3 | |
| SCHEMBL9937400 | 0.80 | GRM5 (0.71) | GRM5CYP1A2GRM3 | |
| SCHEMBL9939097 | 0.80 | GRM5 (0.62) | GRM5CYP1A2GRM3 | |
| SCHEMBL9938652 | 0.80 | GRM5 (0.64) | GRM5CYP1A2GRM3 | |
| SCHEMBL9936827 | 0.80 | GRM5 (0.64) | GRM5CYP1A2GRM3 | |
| SCHEMBL9941195 | 0.79 | GRM5 (0.58) | GRM5CYP1A2GRM3 |
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 |