Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50047793'   

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
Type-1 angiotensin II receptor (RABBIT)	BDBM50047793 (2-{4-[3-butyl-5-(3-methyloxycarbonylbenzylsulfanyl...) Show SMILES CCCCc1nnc(SCc2cccc(c2)C(=O)OC)n1Cc1ccc(NC(=O)c2ccccc2C(O)=O)cc1 Show InChI InChI=1S/C30H30N4O5S/c1-3-4-12-26-32-33-30(40-19-21-8-7-9-22(17-21)29(38)39-2)34(26)18-20-13-15-23(16-14-20)31-27(35)24-10-5-6-11-25(24)28(36)37/h5-11,13-17H,3-4,12,18-19H2,1-2H3,(H,31,35)(H,36,37)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at AT1 receptor in Oryctolagus cuniculus (rabbit) aorta				Citation and Details Article DOI: 10.1007/s00044-011-9756-4 BindingDB Entry DOI: 10.7270/Q2833VXQ
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (RABBIT)	BDBM50047793 (2-{4-[3-butyl-5-(3-methyloxycarbonylbenzylsulfanyl...) Show SMILES CCCCc1nnc(SCc2cccc(c2)C(=O)OC)n1Cc1ccc(NC(=O)c2ccccc2C(O)=O)cc1 Show InChI InChI=1S/C30H30N4O5S/c1-3-4-12-26-32-33-30(40-19-21-8-7-9-22(17-21)29(38)39-2)34(26)18-20-13-15-23(16-14-20)31-27(35)24-10-5-6-11-25(24)28(36)37/h5-11,13-17H,3-4,12,18-19H2,1-2H3,(H,31,35)(H,36,37)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of [125I]-Sar1-Ile8-A II at the rabbit aorta angiotensin II receptor, type 1				J Med Chem 36: 591-609 (1993) BindingDB Entry DOI: 10.7270/Q2P55MKH
					More data for this Ligand-Target Pair