Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Co-chaperonin GroES' and Ligand = 'BDBM50495820'   

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
Co-chaperonin GroES (Escherichia coli)	BDBM50495820 (CHEMBL3115918) Show SMILES Cc1ccc(\C=C2\SC(=S)N(C2=O)c2ccc(C(O)=O)c(O)c2)o1 Show InChI InChI=1S/C16H11NO5S2/c1-8-2-4-10(22-8)7-13-14(19)17(16(23)24-13)9-3-5-11(15(20)21)12(18)6-9/h2-7,18H,1H3,(H,20,21)/b13-7+	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli GroEL/GroES expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH refolding preinc...				Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M
					More data for this Ligand-Target Pair
Co-chaperonin GroES (Escherichia coli)	BDBM50495820 (CHEMBL3115918) Show SMILES Cc1ccc(\C=C2\SC(=S)N(C2=O)c2ccc(C(O)=O)c(O)c2)o1 Show InChI InChI=1S/C16H11NO5S2/c1-8-2-4-10(22-8)7-13-14(19)17(16(23)24-13)9-3-5-11(15(20)21)12(18)6-9/h2-7,18H,1H3,(H,20,21)/b13-7+	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University Curated by ChEMBL					Assay Description Inhibition of Escherichia coli GroEL/GroES-ATPase activity expressed in Escherichia coli DH5alpha/BL21 (DE3) assessed as inhibition of denatured MDH ...				Bioorg Med Chem Lett 24: 786-9 (2014) Article DOI: 10.1016/j.bmcl.2013.12.100 BindingDB Entry DOI: 10.7270/Q27D2Z3M
					More data for this Ligand-Target Pair