Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Histone deacetylase 6' and Ligand = 'BDBM50511230'   

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
Histone deacetylase 6 (Homo sapiens (Human))	BDBM50511230 (CHEMBL4438753) Show SMILES Cc1noc(C)c1-c1nc2sc3CN(CCCCCC(=O)Nc4ccccc4N)CCc3c2c(=O)[nH]1 Show InChI InChI=1S/C26H30N6O3S/c1-15-22(16(2)35-31-15)24-29-25(34)23-17-11-13-32(14-20(17)36-26(23)30-24)12-7-3-4-10-21(33)28-19-9-6-5-8-18(19)27/h5-6,8-9H,3-4,7,10-14,27H2,1-2H3,(H,28,33)(H,29,30,34)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	196	n/a	n/a	n/a	n/a	n/a	n/a
Sichuan University and Collaborative Innovation Center of Biotherapy Curated by ChEMBL					Assay Description Inhibition of HDAC6 (unknown origin) using biotinylated histone H3 KAc peptide (1 to 21 residues) as substrate by HTRF assay				J Med Chem 63: 3678-3700 (2020) Article DOI: 10.1021/acs.jmedchem.9b02178 BindingDB Entry DOI: 10.7270/Q27W6GHJ
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