Reaction Details Report a problem with these data
Target
Group 3 secretory phospholipase A2
Ligand
BDBM114590
Substrate
n/a
Meas. Tech.
QFRET-based biochemical high throughput dose response assay to identify inhibitors of human group III secreted phospholipase A2 enzyme (HGIII-sPLA2)
IC50
31934±n/a nM
Citation
 PubChem, PC QFRET-based biochemical high throughput dose response assay to identify inhibitors of human group III secreted phospholipase A2 enzyme (HGIII-sPLA2) PubChem Bioassay (2014)[AID] 
Target
Name:
Group 3 secretory phospholipase A2
Synonyms:
3.1.1.4 | GIII sPLA2 | Group III secretory phopholipase A2 | Group III secretory phospholipase A2 | PA2G3_HUMAN | PLA2G3 | Phosphatidylcholine 2-acylhydrolase 3 | phospholipase A2, group III | sPLA2-III
Type:
PROTEIN
Mol. Mass.:
57196.58
Organism:
Homo sapiens
Description:
ChEMBL_119722
Residue:
509
Sequence:
MGVQAGLFGMLGFLGVALGGSPALRWYRTSCHLTKAVPGNPLGYLSFLAKDAQGLALIHARWDAHRRLQSCSWEDEPELTAAYGALCAHETAWGSFIHTPGPELQRALATLQSQWEACRALEESPAGARKKRAAGQSGVPGGGHQREKRGWTMPGTLWCGVGDSAGNSSELGVFQGPDLCCREHDRCPQNISPLQYNYGIRNYRFHTISHCDCDTRFQQCLQNQHDSISDIVGVAFFNVLEIPCFVLEEQEACVAWYWWGGCRMYGTVPLARLQPRTFYNASWSSRATSPTPSSRSPAPPKPRQKQHLRKGPPHQKGSKRPSKANTTALQDPMVSPRLDVAPTGLQGPQGGLKPQGARWVCRSFRRHLDQCEHQIGPREIEFQLLNSAQEPLFHCNCTRRLARFLRLHSPPEVTNMLWELLGTTCFKLAPPLDCVEGKNCSRDPRAIRVSARHLRRLQQRRHQLQDKGTDERQPWPSEPLRGPMSFYNQCLQLTQAARRPDRQQKSWSQ
  
Inhibitor
Name:
BDBM114590
Synonyms:
1-[[5-[1,1,2,2,3,3,3-heptakis(fluoranyl)propyl]isoquinolin-1-yl]methylideneamino]thiourea | Hydrazinecarbothioamide, 2-[[5-(heptafluoropropyl)-1-isoquinolinyl]methylene]- | MLS003106944 | SMR001821828 | [[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-isoquinolinyl]methylideneamino]thiourea | [[5-(1,1,2,2,3,3,3-heptafluoropropyl)-1-isoquinolyl]methyleneamino]thiourea | [[5-(1,1,2,2,3,3,3-heptafluoropropyl)isoquinolin-1-yl]methylideneamino]thiourea | cid_4042376
Type:
Small organic molecule
Emp. Form.:
C14H9F7N4S
Mol. Mass.:
398.302
SMILES:
NC(=S)NN=Cc1nccc2c(cccc12)C(F)(F)C(F)(F)C(F)(F)F |w:4.3|
Structure:
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