Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 20/20 | 0.74 |
| ▸ | CYP1A2 | P05177 | 7/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.58 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.55 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL3638850 | 0.89 | GRM5 (0.73) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3643035 | 0.85 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3645226 | 0.85 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3642517 | 0.78 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3640779 | 0.78 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3641376 | 0.78 | GRM5 (1.00) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3636084 | 0.77 | GRM5 (0.77) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL4254669 | 0.77 | GRM5 (0.79) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL8086976 | 0.76 | GRM5 (0.75) | GRM5CYP1A2CYP3A4CACNA1CSCN5A | |
| SCHEMBL3644439 | 0.76 | GRM5 (0.78) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009015897-A1 | NOVEL HETEROCYCLIC COMPOUNDS AS MGLU5 ANTAGONISTS | RECORDATI IRELAND LIMITED (IE) | 2009-02-05 | — | — | WO | disclosed |