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SMILES: COc1ccc(cc1)S(=O)(=O)n1nc(OC(=O)c2ccc(cc2)-c2ccccc2)cc1N

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50583556   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Genome polyprotein (Dengue virus 2)	BDBM50583556 (CHEMBL5083861) Show SMILES COc1ccc(cc1)S(=O)(=O)n1nc(OC(=O)c2ccc(cc2)-c2ccccc2)cc1N Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.25E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Binding affinity to DENV NS2B-NS3 protease assessed as inhibition constant using benzoyl-Nle-Lys-Arg-Arg-AMC as substrate incubated for 60 min by mea...				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00653 BindingDB Entry DOI: 10.7270/Q21J9FNR
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50583556 (CHEMBL5083861) Show SMILES COc1ccc(cc1)S(=O)(=O)n1nc(OC(=O)c2ccc(cc2)-c2ccccc2)cc1N Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DENV NS2B-NS3 protease assessed as fluorescence emission using benzoyl-Nle-Lys-Arg-Arg-AMC as substrate preincubated with enzyme for 60...				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00653 BindingDB Entry DOI: 10.7270/Q21J9FNR
					More data for this Ligand-Target Pair
Genome polyprotein (Dengue virus 2)	BDBM50583556 (CHEMBL5083861) Show SMILES COc1ccc(cc1)S(=O)(=O)n1nc(OC(=O)c2ccc(cc2)-c2ccccc2)cc1N Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of DENV2 NS2B-NS3 protease expressed in Escherichia coli assessed as fluorescence emission using Bz-nKRR-AMC as substrate by microplate re...				Citation and Details Article DOI: 10.1021/acsmedchemlett.1c00653 BindingDB Entry DOI: 10.7270/Q21J9FNR
					More data for this Ligand-Target Pair