Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 288.2 BDBM50485138

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

Found 2 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
Neuraminidase (Influenza A virus)	BDBM50485138 (CHEMBL2029864) Show SMILES COc1c(O)cc2oc3cc(O)ccc3c(=O)c2c1OC Show InChI InChI=1S/C15H12O6/c1-19-14-9(17)6-11-12(15(14)20-2)13(18)8-4-3-7(16)5-10(8)21-11/h3-6,16-17H,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.46E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chosun University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus H1N1 neuraminidase using 4-MU-NANA as substrate by fluorescence assay				Bioorg Med Chem Lett 22: 3688-92 (2012) Article DOI: 10.1016/j.bmcl.2012.04.028 BindingDB Entry DOI: 10.7270/Q27947JG
					More data for this Ligand-Target Pair
Neuraminidase (Influenza A virus)	BDBM50485138 (CHEMBL2029864) Show SMILES COc1c(O)cc2oc3cc(O)ccc3c(=O)c2c1OC Show InChI InChI=1S/C15H12O6/c1-19-14-9(17)6-11-12(15(14)20-2)13(18)8-4-3-7(16)5-10(8)21-11/h3-6,16-17H,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.46E+5	n/a	n/a	n/a	n/a	n/a	n/a
Chosun University Curated by ChEMBL					Assay Description Inhibition of Influenza A virus H9N2 neuraminidase using 4-MU-NANA as substrate by fluorescence assay				Bioorg Med Chem Lett 22: 3688-92 (2012) Article DOI: 10.1016/j.bmcl.2012.04.028 BindingDB Entry DOI: 10.7270/Q27947JG
					More data for this Ligand-Target Pair