Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50047847'   

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)	BDBM50047847 (CHEMBL352235 | N-[4-(3-Benzylsulfanyl-5-butyl-[1,2...) Show SMILES CCCCc1nnc(SCc2ccccc2)n1Cc1ccc(NC(=O)c2ccccc2C(O)=O)cc1 Show InChI InChI=1S/C28H28N4O3S/c1-2-3-13-25-30-31-28(36-19-21-9-5-4-6-10-21)32(25)18-20-14-16-22(17-15-20)29-26(33)23-11-7-8-12-24(23)27(34)35/h4-12,14-17H,2-3,13,18-19H2,1H3,(H,29,33)(H,34,35)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article	n/a	n/a	15	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)	BDBM50047847 (CHEMBL352235 | N-[4-(3-Benzylsulfanyl-5-butyl-[1,2...) Show SMILES CCCCc1nnc(SCc2ccccc2)n1Cc1ccc(NC(=O)c2ccccc2C(O)=O)cc1 Show InChI InChI=1S/C28H28N4O3S/c1-2-3-13-25-30-31-28(36-19-21-9-5-4-6-10-21)32(25)18-20-14-16-22(17-15-20)29-26(33)23-11-7-8-12-24(23)27(34)35/h4-12,14-17H,2-3,13,18-19H2,1H3,(H,29,33)(H,34,35)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	15	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