Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Probable nicotinate-nucleotide adenylyltransferase' and Ligand = 'BDBM70614'   

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
Probable nicotinate-nucleotide adenylyltransferase (Staphylococcus aureus subsp. aureus N315)	BDBM70614 (2-(3,4-dimethylphenyl)-4-[[1-(3,4-dimethylphenyl)-...) Show SMILES Cc1[nH]n(-c2ccc(C)c(C)c2)c(=O)c1C(c1c(C)[nH]n(-c2ccc(C)c(C)c2)c1=O)c1cccc(O)c1 Show InChI InChI=1S/C31H32N4O3/c1-17-10-12-24(14-19(17)3)34-30(37)27(21(5)32-34)29(23-8-7-9-26(36)16-23)28-22(6)33-35(31(28)38)25-13-11-18(2)20(4)15-25/h7-16,29,32-33,36H,1-6H3	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2BV7F7H
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