Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'B2 bradykinin receptor' and Ligand = 'BDBM50146116'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
B2 bradykinin receptor (Homo sapiens (Human))	BDBM50146116 ((E)-3-(6-Acetylamino-pyridin-3-yl)-N-({[2,4-dichlo...) Show SMILES CN(C)c1cc(C)nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)\C=C\c4ccc(NC(C)=O)nc4)c3Cl)cccc12 Show InChI InChI=1S/C32H32Cl2N6O4/c1-19-15-26(39(3)4)22-7-6-8-27(32(22)37-19)44-18-23-24(33)11-12-25(31(23)34)40(5)30(43)17-36-29(42)14-10-21-9-13-28(35-16-21)38-20(2)41/h6-16H,17-18H2,1-5H3,(H,36,42)(H,35,38,41)/b14-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co Ltd Curated by ChEMBL					Assay Description Inhibition of specific binding of [3H]BK at 1 nM to human bradykinin receptor B2 expressed in CHO cells by 50%.				J Med Chem 47: 2667-77 (2004) Article DOI: 10.1021/jm030326t BindingDB Entry DOI: 10.7270/Q2B27W2Q
					More data for this Ligand-Target Pair
B2 bradykinin receptor (Homo sapiens (Human))	BDBM50146116 ((E)-3-(6-Acetylamino-pyridin-3-yl)-N-({[2,4-dichlo...) Show SMILES CN(C)c1cc(C)nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)\C=C\c4ccc(NC(C)=O)nc4)c3Cl)cccc12 Show InChI InChI=1S/C32H32Cl2N6O4/c1-19-15-26(39(3)4)22-7-6-8-27(32(22)37-19)44-18-23-24(33)11-12-25(31(23)34)40(5)30(43)17-36-29(42)14-10-21-9-13-28(35-16-21)38-20(2)41/h6-16H,17-18H2,1-5H3,(H,36,42)(H,35,38,41)/b14-10+	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.30	n/a	n/a	n/a	n/a	n/a	n/a
Fujisawa Pharmaceutical Co Ltd Curated by ChEMBL					Assay Description Inhibition of specific binding of [3H]BK at 0.06 nM to bradykinin receptor B2 in guinea pig ileum membrane preparations by 50%.				J Med Chem 47: 2667-77 (2004) Article DOI: 10.1021/jm030326t BindingDB Entry DOI: 10.7270/Q2B27W2Q
					More data for this Ligand-Target Pair