Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 20/20 | 0.77 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 7/20 | 0.77 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.67 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL4259062 | 0.88 | GRM5 (0.81) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3640981 | 0.86 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3636718 | 0.85 | GRM5 (0.82) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL4261730 | 0.85 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3641600 | 0.84 | GRM5 (0.79) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL4254669 | 0.80 | GRM5 (0.79) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3645178 | 0.79 | GRM5 (0.78) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3676556 | 0.78 | GRM5 (0.71) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL13931793 | 0.78 | GRM5 (0.71) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3639566 | 0.78 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A |
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 4 patents. 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 | claimed |
| EP-2178858-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | Recordati Ireland Limited (IE) | 2010-04-28 | — | — | EP | claimed |
| WO-2009015897-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LIMITED (IE) | 2009-02-05 | — | — | WO | claimed |
| EP-2178858-B1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LTD (IE) | 2011-12-28 | — | — | EP | disclosed |