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SMILES: CN(C)CCc1cc(-c2ccc(cc2)C(=O)NO)c2ccccc12

InChI Key: InChIKey=XTVIUUGKJNXPPJ-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 218229   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Histone deacetylase 1 (Homo sapiens (Human))	BDBM218229 (US9249087, Table 1 , Compound 6) Show SMILES CN(C)CCc1cc(-c2ccc(cc2)C(=O)NO)c2ccccc12 Show InChI InChI=1S/C20H21N2O2/c1-22(2)12-11-16-13-19(18-6-4-3-5-17(16)18)14-7-9-15(10-8-14)20(23)21-24/h3-10,13,24H,11-12H2,1-2H3,(H,21,23)	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	5.86E+3	n/a	n/a	n/a	n/a	8.0	n/a
THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS; THE CHILDREN'S HOSPITAL OF PHILADELPHIA US Patent					Assay Description HDAC assay is performed using fluorescently-labeled acetylated substrate, which comprises an acetylated lysine side chain. After incubation with HDAC...				US Patent US9249087 (2016) BindingDB Entry DOI: 10.7270/Q2Q23Z3W
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM218229 (US9249087, Table 1 , Compound 6) Show SMILES CN(C)CCc1cc(-c2ccc(cc2)C(=O)NO)c2ccccc12 Show InChI InChI=1S/C20H21N2O2/c1-22(2)12-11-16-13-19(18-6-4-3-5-17(16)18)14-7-9-15(10-8-14)20(23)21-24/h3-10,13,24H,11-12H2,1-2H3,(H,21,23)	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	422	n/a	n/a	n/a	n/a	8.0	n/a
THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS; THE CHILDREN'S HOSPITAL OF PHILADELPHIA US Patent					Assay Description HDAC assay is performed using fluorescently-labeled acetylated substrate, which comprises an acetylated lysine side chain. After incubation with HDAC...				US Patent US9249087 (2016) BindingDB Entry DOI: 10.7270/Q2Q23Z3W
					More data for this Ligand-Target Pair
Histone deacetylase 6 (Homo sapiens (Human))	BDBM218229 (US9249087, Table 1 , Compound 6) Show SMILES CN(C)CCc1cc(-c2ccc(cc2)C(=O)NO)c2ccccc12 Show InChI InChI=1S/C20H21N2O2/c1-22(2)12-11-16-13-19(18-6-4-3-5-17(16)18)14-7-9-15(10-8-14)20(23)21-24/h3-10,13,24H,11-12H2,1-2H3,(H,21,23)	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	12.5	n/a	n/a	n/a	n/a	8.0	n/a
THE BOARD OF TRUSTEES OF THE UNIVERSITY OF ILLINOIS; THE CHILDREN'S HOSPITAL OF PHILADELPHIA US Patent					Assay Description HDAC assay is performed using fluorescently-labeled acetylated substrate, which comprises an acetylated lysine side chain. After incubation with HDAC...				US Patent US9249087 (2016) BindingDB Entry DOI: 10.7270/Q2Q23Z3W
					More data for this Ligand-Target Pair