Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 271.2 BDBM50379302

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits in this display   

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
ATP-dependent RNA helicase DDX3X (Homo sapiens (Human))	BDBM50379302 (CHEMBL2011807) Show SMILES Cc1ccccc1NC(=O)Nc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H13N3O3/c1-10-5-2-3-8-13(10)16-14(18)15-11-6-4-7-12(9-11)17(19)20/h2-9H,1H3,(H2,15,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant DDX3 helicase activity expressed in Escherichia coli assessed as conversion of a 6-FAM-labeled double stranded RNA in...				Bioorg Med Chem Lett 22: 2094-8 (2012) Article DOI: 10.1016/j.bmcl.2011.12.135 BindingDB Entry DOI: 10.7270/Q2930V51
					More data for this Ligand-Target Pair
ATP-dependent RNA helicase DDX3X (Homo sapiens (Human))	BDBM50379302 (CHEMBL2011807) Show SMILES Cc1ccccc1NC(=O)Nc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H13N3O3/c1-10-5-2-3-8-13(10)16-14(18)15-11-6-4-7-12(9-11)17(19)20/h2-9H,1H3,(H2,15,16,18)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant DDX3 ATPase activity expressed in Escherichia coli assessed as [gamma-32P] ATP hydrolysis after 5 mins by densitometr...				Bioorg Med Chem Lett 22: 2094-8 (2012) Article DOI: 10.1016/j.bmcl.2011.12.135 BindingDB Entry DOI: 10.7270/Q2930V51
					More data for this Ligand-Target Pair
ATP-dependent RNA helicase DDX1 (Homo sapiens (Human))	BDBM50379302 (CHEMBL2011807) Show SMILES Cc1ccccc1NC(=O)Nc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C14H13N3O3/c1-10-5-2-3-8-13(10)16-14(18)15-11-6-4-7-12(9-11)17(19)20/h2-9H,1H3,(H2,15,16,18)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Siena Curated by ChEMBL					Assay Description Inhibition of human recombinant DDX1 helicase activity expressed in Escherichia coli assessed as conversion of a 6-FAM-labeled double stranded RNA in...				Bioorg Med Chem Lett 22: 2094-8 (2012) Article DOI: 10.1016/j.bmcl.2011.12.135 BindingDB Entry DOI: 10.7270/Q2930V51
					More data for this Ligand-Target Pair