Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Oligo-1,6-glucosidase IMA1' and Ligand = 'BDBM173554'   

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
Oligo-1,6-glucosidase IMA1 (Saccharomyces cerevisiae S288c (Baker's yeast))	BDBM173554 (1-(4-(bis(4-Hydroxy-2-oxo-2H-chromen-3-yl)methyl)p...) Show SMILES Oc1c(C(c2ccc(NC(=S)Nc3cccc(Cl)c3)cc2)c2c(O)c3ccccc3oc2=O)c(=O)oc2ccccc12 Show InChI InChI=1S/C33H24N2O6S/c1-18-8-2-5-11-23(18)35-33(42)34-20-16-14-19(15-17-20)26(27-29(36)21-9-3-6-12-24(21)40-31(27)38)28-30(37)22-10-4-7-13-25(22)41-32(28)39/h2-17,26,36-37H,1H3,(H2,34,35,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.85E+4	n/a	n/a	n/a	n/a	6.8	37
Universiti Teknologi MARA					Assay Description The enzyme inhibition was evaluated according to the method previously reported by Taha et al. with slight modification. Various concentration of tes...				Bioorg Chem 63: 36-44 (2015) Article DOI: 10.1016/j.bioorg.2015.09.004 BindingDB Entry DOI: 10.7270/Q2125RD0
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