Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G7 | Q13093 | 20/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4419833 | 0.92 | PLA2G7 (0.62) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4426152 | 0.92 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4411689 | 0.92 | PLA2G7 (0.66) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4411626 | 0.92 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL4418916 | 0.91 | PLA2G7 (0.65) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4414203 | 0.91 | PLA2G7 (0.66) | PLA2G7CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL4418344 | 0.90 | PLA2G7 (0.64) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4415641 | 0.90 | PLA2G7 (0.65) | PLA2G7CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL6878708 | 0.90 | PLA2G7 (0.63) | PLA2G7CYP3A4CYP2D6 | |
| SCHEMBL4414062 | 0.89 | PLA2G7 (0.70) | PLA2G7CYP3A4CYP2D6 |
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-1479671-B1 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2009-05-27 | — | — | EP | disclosed |
| US-7115616-B2 | Pyrimidinone compounds | SMITHKLINE BEECHAM PLC (GB) | 2006-10-03 | — | — | US | disclosed |
| US-6953803-B1 | 1-[(N-(2-(diethylamino)ethyl)-N-(4-(4-trifluoromethylphenyl)benzyl)aminocarbonylmethyl)]-2-(4-fluorobenzyl)thio-5-(1-methyl-4-pyrazolylmethyl)pyrimidin-4-one; enzyme inhibitors of lipoprotein associated phospholipase A2 (Lp-PLA2); atherosclerosis | SMITHKLINE BEECHAM P.L.C. (GB) | 2005-10-11 | — | — | US | disclosed |