Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Histone deacetylase 6' and Ligand = 'BDBM109968'   

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))	BDBM109968 (US8609678, 4-((2,6-difluorophenyl)(methyl)amino)-N...) Show SMILES CN(c1ccc(cc1)C(=O)NCCCCCCC(=O)NO)c1c(F)cccc1F Show InChI InChI=1S/C21H25F2N3O3/c1-26(20-17(22)7-6-8-18(20)23)16-12-10-15(11-13-16)21(28)24-14-5-3-2-4-9-19(27)25-29/h6-8,10-13,29H,2-5,9,14H2,1H3,(H,24,28)(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2	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))	BDBM109968 (US8609678, 4-((2,6-difluorophenyl)(methyl)amino)-N...) Show SMILES CN(c1ccc(cc1)C(=O)NCCCCCCC(=O)NO)c1c(F)cccc1F Show InChI InChI=1S/C21H25F2N3O3/c1-26(20-17(22)7-6-8-18(20)23)16-12-10-15(11-13-16)21(28)24-14-5-3-2-4-9-19(27)25-29/h6-8,10-13,29H,2-5,9,14H2,1H3,(H,24,28)(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	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))	BDBM109968 (US8609678, 4-((2,6-difluorophenyl)(methyl)amino)-N...) Show SMILES CN(c1ccc(cc1)C(=O)NCCCCCCC(=O)NO)c1c(F)cccc1F Show InChI InChI=1S/C21H25F2N3O3/c1-26(20-17(22)7-6-8-18(20)23)16-12-10-15(11-13-16)21(28)24-14-5-3-2-4-9-19(27)25-29/h6-8,10-13,29H,2-5,9,14H2,1H3,(H,24,28)(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	67	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))	BDBM109968 (US8609678, 4-((2,6-difluorophenyl)(methyl)amino)-N...) Show SMILES CN(c1ccc(cc1)C(=O)NCCCCCCC(=O)NO)c1c(F)cccc1F Show InChI InChI=1S/C21H25F2N3O3/c1-26(20-17(22)7-6-8-18(20)23)16-12-10-15(11-13-16)21(28)24-14-5-3-2-4-9-19(27)25-29/h6-8,10-13,29H,2-5,9,14H2,1H3,(H,24,28)(H,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	121	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