Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Co-chaperonin GroES' and Ligand = 'BDBM50522593'   

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)	BDBM50522593 (CHEMBL1389174) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2o1 Show InChI InChI=1S/C27H23N3O5S2/c1-18-3-12-23(13-4-18)36(31,32)29-21-9-7-20(8-10-21)27-28-25-17-22(11-16-26(25)35-27)30-37(33,34)24-14-5-19(2)6-15-24/h3-17,29-30H,1-2H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Escherichia coli GroEL/ES-mediated refolding of the denatured malate dehydrogenase				Citation and Details Article DOI: 10.1016/j.bmc.2021.116129 BindingDB Entry DOI: 10.7270/Q2DF6W19
					More data for this Ligand-Target Pair
Co-chaperonin GroES (Escherichia coli)	BDBM50522593 (CHEMBL1389174) Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1nc2cc(NS(=O)(=O)c3ccc(C)cc3)ccc2o1 Show InChI InChI=1S/C27H23N3O5S2/c1-18-3-12-23(13-4-18)36(31,32)29-21-9-7-20(8-10-21)27-28-25-17-22(11-16-26(25)35-27)30-37(33,34)24-14-5-19(2)6-15-24/h3-17,29-30H,1-2H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of Escherichia coli GroEL/ES-mediated refolding of the denatured rhodanese				Citation and Details Article DOI: 10.1016/j.bmc.2021.116129 BindingDB Entry DOI: 10.7270/Q2DF6W19
					More data for this Ligand-Target Pair