Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'NH(3)-dependent NAD(+) synthetase' and Ligand = 'BDBM50130799'   

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)	BDBM50130799 (CHEMBL114967 | Trimethyl-{4-[9-(5-nitro-indol-1-yl...) Show SMILES C[N+](C)(C)c1ccc(CC(=O)OCCCCCCCCCn2ccc3cc(ccc23)[N+]([O-])=O)cc1 Show InChI InChI=1S/C28H38N3O4/c1-31(2,3)26-14-11-23(12-15-26)21-28(32)35-20-10-8-6-4-5-7-9-18-29-19-17-24-22-25(30(33)34)13-16-27(24)29/h11-17,19,22H,4-10,18,20-21H2,1-3H3/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	2.40E+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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