Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 438.4 BDBM50122447

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

Found 1 hit 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
Polymerase acidic protein (Influenza A virus (strain A/X-31 H3N2))	BDBM50122447 (CHEMBL3622460) Show SMILES Oc1cc2cc([nH]c2cc1O)C(=O)NCCCCNC(=O)c1cc2cc(O)c(O)cc2[nH]1 Show InChI InChI=1S/C22H22N4O6/c27-17-7-11-5-15(25-13(11)9-19(17)29)21(31)23-3-1-2-4-24-22(32)16-6-12-8-18(28)20(30)10-14(12)26-16/h5-10,25-30H,1-4H2,(H,23,31)(H,24,32)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Sassari Curated by ChEMBL					Assay Description Inhibition of recombinant Influenza virus A/X-31 N-terminal RdRp PA subunit (1 to 217) expressed in Escherichia coli using single-stranded circular D...				ACS Med Chem Lett 6: 866-71 (2015) Article DOI: 10.1021/acsmedchemlett.5b00109 BindingDB Entry DOI: 10.7270/Q27S7QKP
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