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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Bradykinin B1 receptor' and Ligand = 'BDBM50362317'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bradykinin B1 receptor


(Homo sapiens (Human))
BDBM50362317
PNG
(CHEMBL1938412)
Show SMILES CN(C)C1CCCN(CC1)C(=O)C[C@H]1N(C=CNC1=O)S(=O)(=O)c1cc(C)c(Cl)cc1C |r,c:16|
Show InChI InChI=1S/C22H31ClN4O4S/c1-15-13-20(16(2)12-18(15)23)32(30,31)27-11-8-24-22(29)19(27)14-21(28)26-9-5-6-17(7-10-26)25(3)4/h8,11-13,17,19H,5-7,9-10,14H2,1-4H3,(H,24,29)/t17?,19-/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.70n/an/an/an/an/an/a



Amgen, Inc.

Curated by ChEMBL


Assay Description
Antagonist activity at human bradykinin B1 receptor expressed in CHO-D-/aequorin cells assessed as inhibition of DAK-induced intracellular calcium le...


Bioorg Med Chem Lett 22: 1061-7 (2012)


Article DOI: 10.1016/j.bmcl.2011.11.112
BindingDB Entry DOI: 10.7270/Q22J6CB2
More data for this
Ligand-Target Pair