Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Stress-70 protein, mitochondrial' and Ligand = 'BDBM50539107'   

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
Stress-70 protein, mitochondrial (Homo sapiens)	BDBM50539107 (CHEMBL4639280) Show SMILES [I-].CC1(C)CC[N+](C)(C)c2ccc(NC(=O)Nc3ccc(cc3)[N+]([O-])=O)cc12 Show InChI InChI=1S/C20H24N4O3/c1-20(2)11-12-24(3,4)18-10-7-15(13-17(18)20)22-19(25)21-14-5-8-16(9-6-14)23(26)27/h5-10,13H,11-12H2,1-4H3,(H-,21,22,25)/p+1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a
Oklahoma State University Curated by ChEMBL					Assay Description Binding affinity to mortalin substrate binding domain (unknown origin)				Bioorg Med Chem 28: (2020) Article DOI: 10.1016/j.bmc.2019.115244 BindingDB Entry DOI: 10.7270/Q2WD443B
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