Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 6' and Ligand = 'BDBM110112'   

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))	BDBM110112 (US8609678, 2-((2-(1H-indol-3-yl)ethyl)(2-hydroxyet...) Show SMILES OCCN(CCc1c[nH]c2ccccc12)c1ncc(cn1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C24H32N6O4/c31-14-13-30(12-10-18-15-26-21-8-5-4-7-20(18)21)24-27-16-19(17-28-24)23(33)25-11-6-2-1-3-9-22(32)29-34/h4-5,7-8,15-17,26,31,34H,1-3,6,9-14H2,(H,25,33)(H,29,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.4	n/a
Acetylon Pharmaceuticals US Patent					Assay Description Compounds for testing were diluted in DMSO to 50 fold the final concentration and a ten point three fold dilution series was made. The compounds were...				US Patent US8609678 (2013) BindingDB Entry DOI: 10.7270/Q25M64BS
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM110112 (US8609678, 2-((2-(1H-indol-3-yl)ethyl)(2-hydroxyet...) Show SMILES OCCN(CCc1c[nH]c2ccccc12)c1ncc(cn1)C(=O)NCCCCCCC(=O)NO Show InChI InChI=1S/C24H32N6O4/c31-14-13-30(12-10-18-15-26-21-8-5-4-7-20(18)21)24-27-16-19(17-28-24)23(33)25-11-6-2-1-3-9-22(32)29-34/h4-5,7-8,15-17,26,31,34H,1-3,6,9-14H2,(H,25,33)(H,29,32)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	35	n/a	n/a	n/a	n/a	7.4	n/a
Acetylon Pharmaceuticals US Patent					Assay Description Compounds for testing were diluted in DMSO to 50 fold the final concentration and a ten point three fold dilution series was made. The compounds were...				US Patent US8609678 (2013) BindingDB Entry DOI: 10.7270/Q25M64BS
					More data for this Ligand-Target Pair