Compile Data Set for Download or QSAR
Found 2 Enz. Inhib. hit(s) with Target = 'B2 bradykinin receptor' and Ligand = 'BDBM50293873'
TargetB2 bradykinin receptor(Homo sapiens (Human))
Jerini AG

Curated by ChEMBL
LigandPNGBDBM50293873(5-(8-((3,5-dichloropyridin-4-yl)methoxy)-2-methylq...)
Show SMILES Cc1cc(-c2cncs2)c2cccc(OCc3c(Cl)cncc3Cl)c2n1
Show InChI InChI=1S/C19H13Cl2N3OS/c1-11-5-13(18-8-23-10-26-18)12-3-2-4-17(19(12)24-11)25-9-14-15(20)6-22-7-16(14)21/h2-8,10H,9H2,1H3
Affinity DataIC50: 135nMAssay Description:Displacement of [3H]bradykinin from human recombinant B2 receptor expressed in HEK293 cellsMore data for this Ligand-Target Pair
TargetB2 bradykinin receptor(Homo sapiens (Human))
Jerini AG

Curated by ChEMBL
LigandPNGBDBM50293873(5-(8-((3,5-dichloropyridin-4-yl)methoxy)-2-methylq...)
Show SMILES Cc1cc(-c2cncs2)c2cccc(OCc3c(Cl)cncc3Cl)c2n1
Show InChI InChI=1S/C19H13Cl2N3OS/c1-11-5-13(18-8-23-10-26-18)12-3-2-4-17(19(12)24-11)25-9-14-15(20)6-22-7-16(14)21/h2-8,10H,9H2,1H3
Affinity DataIC50: 420nMAssay Description:Antagonist activity at B2 receptor in human HF15 cells assessed as inhibition of bradykinin-induced calcium mobilizationMore data for this Ligand-Target Pair