Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor' and Ligand = 'BDBM50283159'   

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))	BDBM50283159 (5-[4-(2-Methoxy-phenyl)-piperazin-1-ylmethyl]-2-pr...) Show SMILES CCCc1nc(CN2CCN(CC2)c2ccccc2OC)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1 Show InChI InChI=1S/C33H36N8O3/c1-3-8-30-34-27(22-39-17-19-40(20-18-39)28-11-6-7-12-29(28)44-2)31(33(42)43)41(30)21-23-13-15-24(16-14-23)25-9-4-5-10-26(25)32-35-37-38-36-32/h4-7,9-16H,3,8,17-22H2,1-2H3,(H,42,43)(H,35,36,37,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro binding affinity of compound against Angiotensin II receptor, type 1				Bioorg Med Chem Lett 4: 2229-2234 (1994) Article DOI: 10.1016/S0960-894X(00)80076-1 BindingDB Entry DOI: 10.7270/Q2JQ110M
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