Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 14/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 3/20 | 0.35 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15214300 | 0.84 | GRM5 (0.73) | GRM5CYP3A4CYP1A2HSD11B1TRPV1 | |
| SCHEMBL13932037 | 0.84 | GRM5 (0.50) | GRM5CYP3A4CYP1A2 | |
| SCHEMBL15214296 | 0.83 | GRM5 (0.70) | GRM5CYP3A4CYP1A2TRPV1MALT1 | |
| SCHEMBL16502088 | 0.83 | GRM5 (0.55) | GRM5CYP3A4CYP1A2HSD11B1TRPV1 | |
| SCHEMBL15214305 | 0.83 | GRM5 (0.59) | GRM5CYP3A4CYP1A2HSD11B1TRPV1 | |
| SCHEMBL3641985 | 0.83 | GRM5 (0.74) | GRM5CYP3A4CYP1A2 | |
| SCHEMBL15214310 | 0.82 | GRM5 (0.53) | GRM5CYP3A4CYP1A2HSD11B1TRPV1 | |
| SCHEMBL15214311 | 0.81 | GRM5 (0.57) | GRM5CYP3A4CYP1A2MALT1 | |
| SCHEMBL16502096 | 0.81 | GRM5 (0.50) | GRM5CYP3A4CYP1A2HSD11B1MALT1 | |
| SCHEMBL16502099 | 0.79 | GRM5 (0.52) | GRM5CYP3A4CYP1A2HSD11B1TRPV1 |
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-2178858-B1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LTD (IE) | 2011-12-28 | — | — | EP | disclosed |