Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NH(3)-dependent NAD(+) synthetase' and Ligand = 'BDBM50130797'   

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
NH(3)-dependent NAD(+) synthetase (Bacillus subtilis)	BDBM50130797 (3-[8-(5-Hydroxy-indol-1-yl)-octyloxycarbonyl]-pyri...) Show SMILES Oc1ccc2n(CCCCCCCCOC(=O)c3ccc[nH+]c3)ccc2c1 Show InChI InChI=1S/C22H26N2O3/c25-20-9-10-21-18(16-20)11-14-24(21)13-5-3-1-2-4-6-15-27-22(26)19-8-7-12-23-17-19/h7-12,14,16-17,25H,1-6,13,15H2/p+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Alabama at Birmingham Curated by ChEMBL					Assay Description Inhibitory activity against Bacillus subtilis NAD synthetase				J Med Chem 46: 3371-81 (2003) Article DOI: 10.1021/jm030003x BindingDB Entry DOI: 10.7270/Q25T3M6Q
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