Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50030712'   

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)	BDBM50030712 (2-Ethoxy-N-{3-[4-(3-fluoro-2'-(N-t-butyloxycarbony...) Show SMILES CCCc1nn(-c2cc(NC(=O)COCC)ccc2C(F)(F)F)c(=O)n1Cc1ccc(cc1F)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H37F4N5O7S/c1-6-10-29-40-43(27-18-23(39-30(44)20-49-7-2)15-16-25(27)34(36,37)38)32(46)42(29)19-22-14-13-21(17-26(22)35)24-11-8-9-12-28(24)51(47,48)41-31(45)50-33(3,4)5/h8-9,11-18H,6-7,10,19-20H2,1-5H3,(H,39,44)(H,41,45)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin II receptor, type 1 in rabbit aorta membrane preparations.				J Med Chem 38: 3741-58 (1995) BindingDB Entry DOI: 10.7270/Q2Q81C35
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (RABBIT)	BDBM50030712 (2-Ethoxy-N-{3-[4-(3-fluoro-2'-(N-t-butyloxycarbony...) Show SMILES CCCc1nn(-c2cc(NC(=O)COCC)ccc2C(F)(F)F)c(=O)n1Cc1ccc(cc1F)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H37F4N5O7S/c1-6-10-29-40-43(27-18-23(39-30(44)20-49-7-2)15-16-25(27)34(36,37)38)32(46)42(29)19-22-14-13-21(17-26(22)35)24-11-8-9-12-28(24)51(47,48)41-31(45)50-33(3,4)5/h8-9,11-18H,6-7,10,19-20H2,1-5H3,(H,39,44)(H,41,45)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at Oryctolagus cuniculus (rabbit) aortic AT1 receptor				Citation and Details Article DOI: 10.1007/s00044-011-9815-x BindingDB Entry DOI: 10.7270/Q2VT1W0S
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (Homo sapiens (Human))	BDBM50030712 (2-Ethoxy-N-{3-[4-(3-fluoro-2'-(N-t-butyloxycarbony...) Show SMILES CCCc1nn(-c2cc(NC(=O)COCC)ccc2C(F)(F)F)c(=O)n1Cc1ccc(cc1F)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H37F4N5O7S/c1-6-10-29-40-43(27-18-23(39-30(44)20-49-7-2)15-16-25(27)34(36,37)38)32(46)42(29)19-22-14-13-21(17-26(22)35)24-11-8-9-12-28(24)51(47,48)41-31(45)50-33(3,4)5/h8-9,11-18H,6-7,10,19-20H2,1-5H3,(H,39,44)(H,41,45)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity against Angiotensin II receptor, type 1 in rabbit aorta membrane preparations.				J Med Chem 38: 3741-58 (1995) BindingDB Entry DOI: 10.7270/Q2Q81C35
					More data for this Ligand-Target Pair
Type-1 angiotensin II receptor (RABBIT)	BDBM50030712 (2-Ethoxy-N-{3-[4-(3-fluoro-2'-(N-t-butyloxycarbony...) Show SMILES CCCc1nn(-c2cc(NC(=O)COCC)ccc2C(F)(F)F)c(=O)n1Cc1ccc(cc1F)-c1ccccc1S(=O)(=O)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H37F4N5O7S/c1-6-10-29-40-43(27-18-23(39-30(44)20-49-7-2)15-16-25(27)34(36,37)38)32(46)42(29)19-22-14-13-21(17-26(22)35)24-11-8-9-12-28(24)51(47,48)41-31(45)50-33(3,4)5/h8-9,11-18H,6-7,10,19-20H2,1-5H3,(H,39,44)(H,41,45)	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Antagonist activity at Oryctolagus cuniculus (rabbit) aortic AT1 receptor				Citation and Details Article DOI: 10.1007/s00044-011-9815-x BindingDB Entry DOI: 10.7270/Q2VT1W0S
					More data for this Ligand-Target Pair