Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50490699'   

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 (Homo sapiens (Human))	BDBM50490699 (CHEMBL2337681) Show SMILES [Br-].CCCCc1c(Br)[n+](Cc2ccc(cc2)-c2ccccc2-c2nn[nH]n2)c(CO)n1Cc1ccc(cc1)-c1ccccc1-c1nn[nH]n1 Show InChI InChI=1S/C36H34BrN10O/c1-2-3-12-32-34(37)47(22-25-15-19-27(20-16-25)29-9-5-7-11-31(29)36-40-44-45-41-36)33(23-48)46(32)21-24-13-17-26(18-14-24)28-8-4-6-10-30(28)35-38-42-43-39-35/h4-11,13-20,48H,2-3,12,21-23H2,1H3,(H,38,39,42,43)(H,40,41,44,45)/q+1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
University of Patras Curated by ChEMBL					Assay Description Displacement of [125I-Sar1-Ile8]-ANG2 from human Angiotensin 2 type-1 receptor expressed in HEK293 cells after 1 hr by gamma counting analysis				Eur J Med Chem 62: 352-70 (2013) Article DOI: 10.1016/j.ejmech.2012.12.044 BindingDB Entry DOI: 10.7270/Q2DF6V47
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