Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 16/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL4291588 | 0.78 | GRM5 (1.00) | GRM5 | |
| SCHEMBL4143647 | 0.78 | GRM5 (1.00) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL4142443 | 0.75 | GRM5 (1.00) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL15049682 | 0.74 | GRM5 (1.00) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL4145767 | 0.73 | GRM5 (0.72) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL1244096 | 0.72 | GRM5 (0.67) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL1244088 | 0.72 | GRM5 (0.66) | GRM5 | |
| SCHEMBL5653763 | 0.71 | GRM5 (0.70) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL14573619 | 0.71 | GRM5 (0.70) | GRM5CYP1A2CYP2D6 | |
| SCHEMBL4156970 | 0.71 | GRM5 (1.00) | GRM5CYP1A2CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1556142-A4 | ALKYNE DERIVATIVES AS TRACERS FOR METABOTROPIC GLUTAMATE RECEPTOR BINDING | MERCK & CO INC (US) | 2006-11-08 | — | — | EP | disclosed |
| EP-1556142-A2 | ALKYNE DERIVATIVES AS TRACERS FOR METABOTROPIC GLUTAMATE RECEPTOR BINDING | Merck & Co., Inc. (US) | 2005-07-27 | — | — | EP | disclosed |
| WO-2004038374-A2 | ALKYNE DERIVATIVES AS TRACERS FOR METABOTROPIC GLUTAMATE RECEPTOR BINDING | MERCK & CO., INC. (US) | 2004-05-06 | — | — | WO | disclosed |