Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Type-1 angiotensin II receptor B' and Ligand = 'BDBM50042257'   

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 B (RAT)	BDBM50042257 (4'-(2-Butyl-4-oxo-1,3,8-triaza-spiro[4.5]dec-1-en-...) Show SMILES CCCCC1=NC2(CCNCC2)C(=O)N1Cc1ccc(cc1)-c1ccccc1C(O)=O |t:4| Show InChI InChI=1S/C25H29N3O3/c1-2-3-8-22-27-25(13-15-26-16-14-25)24(31)28(22)17-18-9-11-19(12-10-18)20-6-4-5-7-21(20)23(29)30/h4-7,9-12,26H,2-3,8,13-17H2,1H3,(H,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	890	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi Recherche Curated by ChEMBL					Assay Description Binding affinity for Angiotensin II receptor, type 1 measured by ability to displace [125I]- A II from its specific binding site in rat liver membran...				J Med Chem 36: 3371-80 (1993) BindingDB Entry DOI: 10.7270/Q22Z14M0
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