Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NH(3)-dependent NAD(+) synthetase' and Ligand = 'BDBM50130817'   

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)	BDBM50130817 (CHEMBL116217 | Trimethyl-{4-[5-(5-nitro-indol-1-yl...) Show SMILES C[N+](C)(C)c1ccc(CC(=O)OCCCCCn2ccc3cc(ccc23)[N+]([O-])=O)cc1 Show InChI InChI=1S/C24H30N3O4/c1-27(2,3)22-10-7-19(8-11-22)17-24(28)31-16-6-4-5-14-25-15-13-20-18-21(26(29)30)9-12-23(20)25/h7-13,15,18H,4-6,14,16-17H2,1-3H3/q+1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.00E+4	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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