Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.35 |
| ▸ | GRM5 | P41594 | 2/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.32 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL22993442 | 0.85 | PDE10A (0.44) | PDE10AGRM5DPP4 | |
| SCHEMBL25045610 | 0.79 | HRH3 (0.30) | HRH3 | |
| SCHEMBL8277491 | 0.79 | HRH3 (0.48) | PDE10AGRM5HRH3ADORA2A | |
| SCHEMBL12706683 | 0.75 | PDE10A (0.34) | PDE10AGRM5HRH3 | |
| SCHEMBL14111064 | 0.73 | PDE10A (0.40) | PDE10AGRM5HRH3DPP4 | |
| SCHEMBL24202747 | 0.71 | ADORA2A (0.43) | HRH3ADORA2A | |
| SCHEMBL16219073 | 0.69 | GRM5 (0.42) | GRM5DPP4 | |
| SCHEMBL21452307 | 0.69 | GRM5 (0.37) | GRM5HRH3DPP4ADORA2A | |
| SCHEMBL14907170 | 0.69 | GRM5 (0.40) | GRM5HRH3DPP4 | |
| SCHEMBL2666128 | 0.67 | — | — |
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-2470021-B1 | NOVEL PYRROLIDINE DERIVED BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME (US) | 2014-10-22 | — | — | EP | disclosed |