Reaction Details Report a problem with these data
Target
Phospholipase A2
Ligand
BDBM50336349
Substrate
n/a
Meas. Tech.
ChEMBL_716743 (CHEMBL1670625)
IC50
1570000±n/a nM
Citation
 Wang, J; Bourguet-Kondracki, ML; Longeon, A; Dubois, J; Valentin, A; Copp, BR Chemical and biological explorations of the electrophilic reactivity of the bioactive marine natural product halenaquinone with biomimetic nucleophiles. Bioorg Med Chem Lett 21:1261-4 (2011) [PubMed]  Article 
Target
Name:
Phospholipase A2
Synonyms:
Allergen Api m I | Allergen=Api m 1 | PA2_APIME | Phosphatidylcholine 2-acylhydrolase | Phospholipase A2 (Bee)
Type:
PROTEIN
Mol. Mass.:
19061.47
Organism:
Apis mellifera
Description:
ChEMBL_1277435
Residue:
167
Sequence:
MQVVLGSLFLLLLSTSHGWQIRDRIGDNELEERIIYPGTLWCGHGNKSSGPNELGRFKHTDACCRTHDMCPDVMSAGESKHGLTNTASHTRLSCDCDDKFYDCLKNSADTISSYFVGKMYFNLIDTKCYKLEHPVTGCGERTEGRCLHYTVDKSKPKVYQWFDLRKY
  
Inhibitor
Name:
BDBM50336349
Synonyms:
CHEMBL1668038 | Orhalquinone
Type:
Small organic molecule
Emp. Form.:
C20H18O3
Mol. Mass.:
306.3551
SMILES:
CC1=C2C(=O)Cc3cc4C(=O)C=CC(=O)c4cc3C2(C)CCC1 |c:1,11|
Structure:
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