Compile Data Set for Download or QSAR

Found 65 hits Enz. Inhib. hit(s) with all data for entry = 6299   

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 8 (Homo sapiens (Human))	BDBM120985 (US8716285, 42) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C17H17ClN2O4S/c18-14-2-1-3-16(10-14)25(23,24)20-15-7-6-11-4-5-12(17(21)19-22)8-13(11)9-15/h1-5,8,10,15,20,22H,6-7,9H2,(H,19,21)	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	160	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120989 (US8716285, 46) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1ccc(Cl)cc1Cl Show InChI InChI=1S/C17H16Cl2N2O4S/c18-13-4-6-16(15(19)9-13)26(24,25)21-14-5-3-10-1-2-11(17(22)20-23)7-12(10)8-14/h1-2,4,6-7,9,14,21,23H,3,5,8H2,(H,20,22)	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	190	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120987 (US8716285, 44) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1ccc(F)cc1F Show InChI InChI=1S/C17H16F2N2O4S/c18-13-4-6-16(15(19)9-13)26(24,25)21-14-5-3-10-1-2-11(17(22)20-23)7-12(10)8-14/h1-2,4,6-7,9,14,21,23H,3,5,8H2,(H,20,22)	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	210	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120955 (US8716285, 12) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C21H19FN4O2/c22-17-6-3-14(4-7-17)19-9-10-23-21(25-19)24-18-8-5-13-1-2-15(20(27)26-28)11-16(13)12-18/h1-4,6-7,9-11,18,28H,5,8,12H2,(H,26,27)(H,23,24,25)	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	260	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120952 (US8716285, 9) Show SMILES CCOc1cc(C)nc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C18H22N4O3/c1-3-25-16-8-11(2)19-18(21-16)20-15-7-6-12-4-5-13(17(23)22-24)9-14(12)10-15/h4-5,8-9,15,24H,3,6-7,10H2,1-2H3,(H,22,23)(H,19,20,21)	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	290	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120958 (US8716285, 15) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccccc1Cl Show InChI InChI=1S/C21H19ClN4O2/c22-18-4-2-1-3-17(18)19-9-10-23-21(25-19)24-16-8-7-13-5-6-14(20(27)26-28)11-15(13)12-16/h1-6,9-11,16,28H,7-8,12H2,(H,26,27)(H,23,24,25)	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	300	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120951 (US8716285, 8) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)C(F)(F)F Show InChI InChI=1S/C16H15F3N4O2/c17-16(18,19)13-5-6-20-15(22-13)21-12-4-3-9-1-2-10(14(24)23-25)7-11(9)8-12/h1-2,5-7,12,25H,3-4,8H2,(H,23,24)(H,20,21,22)	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	300	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120974 (US8716285, 31) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(nc1)N1CCOCC1 Show InChI InChI=1S/C24H26N6O3/c31-23(29-32)17-2-1-16-3-5-20(14-19(16)13-17)27-24-25-8-7-21(28-24)18-4-6-22(26-15-18)30-9-11-33-12-10-30/h1-2,4,6-8,13,15,20,32H,3,5,9-12,14H2,(H,29,31)(H,25,27,28)	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	320	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120983 (US8716285, 40) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C17H17FN2O4S/c18-14-2-1-3-16(10-14)25(23,24)20-15-7-6-11-4-5-12(17(21)19-22)8-13(11)9-15/h1-5,8,10,15,20,22H,6-7,9H2,(H,19,21)	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	350	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120991 (US8716285, 48) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1cccnc1 Show InChI InChI=1S/C16H17N3O4S/c20-16(18-21)12-4-3-11-5-6-14(9-13(11)8-12)19-24(22,23)15-2-1-7-17-10-15/h1-4,7-8,10,14,19,21H,5-6,9H2,(H,18,20)	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	370	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120986 (US8716285, 43) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C18H17F3N2O4S/c19-18(20,21)14-2-1-3-16(10-14)28(26,27)23-15-7-6-11-4-5-12(17(24)22-25)8-13(11)9-15/h1-5,8,10,15,23,25H,6-7,9H2,(H,22,24)	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	370	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120988 (US8716285, 45) Show SMILES COc1ccc(cc1OC)S(=O)(=O)NC1CCc2ccc(cc2C1)C(=O)NO Show InChI InChI=1S/C19H22N2O6S/c1-26-17-8-7-16(11-18(17)27-2)28(24,25)21-15-6-5-12-3-4-13(19(22)20-23)9-14(12)10-15/h3-4,7-9,11,15,21,23H,5-6,10H2,1-2H3,(H,20,22)	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	390	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120996 (US8716285, 53) Show SMILES ONC(=O)c1ccc2NCC(Cc2c1)Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C19H18N6O2/c26-18(25-27)12-3-4-16-14(8-12)9-15(11-22-16)23-19-21-7-5-17(24-19)13-2-1-6-20-10-13/h1-8,10,15,22,27H,9,11H2,(H,25,26)(H,21,23,24)	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	470	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120990 (US8716285, 47) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1ccc(Cl)c(Cl)c1 Show InChI InChI=1S/C17H16Cl2N2O4S/c18-15-6-5-14(9-16(15)19)26(24,25)21-13-4-3-10-1-2-11(17(22)20-23)7-12(10)8-13/h1-2,5-7,9,13,21,23H,3-4,8H2,(H,20,22)	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	470	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120968 (US8716285, 25) Show SMILES Cc1ccc(cn1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C21H21N5O2/c1-13-2-3-16(12-23-13)19-8-9-22-21(25-19)24-18-7-6-14-4-5-15(20(27)26-28)10-17(14)11-18/h2-5,8-10,12,18,28H,6-7,11H2,1H3,(H,26,27)(H,22,24,25)	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	480	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120977 (US8716285, 34) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1cnc2ccccc2c1 Show InChI InChI=1S/C24H21N5O2/c30-23(29-31)17-6-5-15-7-8-20(13-18(15)12-17)27-24-25-10-9-22(28-24)19-11-16-3-1-2-4-21(16)26-14-19/h1-6,9-12,14,20,31H,7-8,13H2,(H,29,30)(H,25,27,28)	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	480	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120973 (US8716285, 30) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1cccnc1Cl Show InChI InChI=1S/C20H18ClN5O2/c21-18-16(2-1-8-22-18)17-7-9-23-20(25-17)24-15-6-5-12-3-4-13(19(27)26-28)10-14(12)11-15/h1-4,7-10,15,28H,5-6,11H2,(H,26,27)(H,23,24,25)	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	510	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120970 (US8716285, 27) Show SMILES COc1cncc(c1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C21H21N5O3/c1-29-18-10-16(11-22-12-18)19-6-7-23-21(25-19)24-17-5-4-13-2-3-14(20(27)26-28)8-15(13)9-17/h2-3,6-8,10-12,17,28H,4-5,9H2,1H3,(H,26,27)(H,23,24,25)	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	520	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120969 (US8716285, 26) Show SMILES Cc1cncc(c1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C21H21N5O2/c1-13-8-17(12-22-11-13)19-6-7-23-21(25-19)24-18-5-4-14-2-3-15(20(27)26-28)9-16(14)10-18/h2-3,6-9,11-12,18,28H,4-5,10H2,1H3,(H,26,27)(H,23,24,25)	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	520	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120945 (US8716285, 2) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ccc(Br)cc1 Show InChI InChI=1S/C17H17BrN2O2/c18-14-4-7-15(8-5-14)19-16-6-3-11-1-2-12(17(21)20-22)9-13(11)10-16/h1-2,4-5,7-9,16,19,22H,3,6,10H2,(H,20,21)	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	680	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120967 (US8716285, 24) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C20H19N5O2/c26-19(25-27)14-4-3-13-5-6-17(11-16(13)10-14)23-20-22-9-7-18(24-20)15-2-1-8-21-12-15/h1-4,7-10,12,17,27H,5-6,11H2,(H,25,26)(H,22,23,24)	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	720	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120950 (US8716285, 7) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ncccn1 Show InChI InChI=1S/C15H16N4O2/c20-14(19-21)11-3-2-10-4-5-13(9-12(10)8-11)18-15-16-6-1-7-17-15/h1-3,6-8,13,21H,4-5,9H2,(H,19,20)(H,16,17,18)	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	730	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121008 (US8716285, 65) Show SMILES CN1CC(Cc2cc(ccc12)C(=O)NO)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H18ClN3O4S/c1-21-10-14(20-26(24,25)15-5-3-13(18)4-6-15)9-12-8-11(17(22)19-23)2-7-16(12)21/h2-8,14,20,23H,9-10H2,1H3,(H,19,22)	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	750	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120954 (US8716285, 11) Show SMILES Cc1ccc(cc1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C22H22N4O2/c1-14-2-4-16(5-3-14)20-10-11-23-22(25-20)24-19-9-8-15-6-7-17(21(27)26-28)12-18(15)13-19/h2-7,10-12,19,28H,8-9,13H2,1H3,(H,26,27)(H,23,24,25)	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	800	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120959 (US8716285, 16) Show SMILES CN(C)c1cccc(c1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C23H25N5O2/c1-28(2)20-5-3-4-16(14-20)21-10-11-24-23(26-21)25-19-9-8-15-6-7-17(22(29)27-30)12-18(15)13-19/h3-7,10-12,14,19,30H,8-9,13H2,1-2H3,(H,27,29)(H,24,25,26)	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	800	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121009 (US8716285, 66) Show SMILES ONC(=O)c1ccc2OCC(Cc2c1)Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C19H17N5O3/c25-18(24-26)12-3-4-17-14(8-12)9-15(11-27-17)22-19-21-7-5-16(23-19)13-2-1-6-20-10-13/h1-8,10,15,26H,9,11H2,(H,24,25)(H,21,22,23)	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	830	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120984 (US8716285, 41) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H17ClN2O4S/c18-14-4-7-16(8-5-14)25(23,24)20-15-6-3-11-1-2-12(17(21)19-22)9-13(11)10-15/h1-2,4-5,7-9,15,20,22H,3,6,10H2,(H,19,21)	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	850	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120972 (US8716285, 29) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(Cl)nc1 Show InChI InChI=1S/C20H18ClN5O2/c21-18-6-4-14(11-23-18)17-7-8-22-20(25-17)24-16-5-3-12-1-2-13(19(27)26-28)9-15(12)10-16/h1-2,4,6-9,11,16,28H,3,5,10H2,(H,26,27)(H,22,24,25)	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	900	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120982 (US8716285, 39) Show SMILES CCCCS(=O)(=O)NC1CCc2ccc(cc2C1)C(=O)NO Show InChI InChI=1S/C15H22N2O4S/c1-2-3-8-22(20,21)17-14-7-6-11-4-5-12(15(18)16-19)9-13(11)10-14/h4-5,9,14,17,19H,2-3,6-8,10H2,1H3,(H,16,18)	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	910	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120949 (US8716285, 6) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ccc(cn1)[N+]([O-])=O Show InChI InChI=1S/C16H16N4O4/c21-16(19-22)11-2-1-10-3-4-13(8-12(10)7-11)18-15-6-5-14(9-17-15)20(23)24/h1-2,5-7,9,13,22H,3-4,8H2,(H,17,18)(H,19,21)	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	930	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120995 (US8716285, 52) Show SMILES ONC(=O)c1cc2CC(CCc2cc1F)NS(=O)(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C17H16ClFN2O4S/c18-12-2-1-3-14(9-12)26(24,25)21-13-5-4-10-8-16(19)15(17(22)20-23)7-11(10)6-13/h1-3,7-9,13,21,23H,4-6H2,(H,20,22)	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	930	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121004 (US8716285, 61) Show SMILES ONC(=O)c1ccc2NCC(Cc2c1)NS(=O)(=O)c1cccc(Cl)c1 Show InChI InChI=1S/C16H16ClN3O4S/c17-12-2-1-3-14(8-12)25(23,24)20-13-7-11-6-10(16(21)19-22)4-5-15(11)18-9-13/h1-6,8,13,18,20,22H,7,9H2,(H,19,21)	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	970	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120980 (US8716285, 37) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NC(=O)\C=C\c1cccnc1 Show InChI InChI=1S/C19H19N3O3/c23-18(8-3-13-2-1-9-20-12-13)21-17-7-6-14-4-5-15(19(24)22-25)10-16(14)11-17/h1-5,8-10,12,17,25H,6-7,11H2,(H,21,23)(H,22,24)/b8-3+	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	990	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120971 (US8716285, 28) Show SMILES COc1ccc(cn1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C21H21N5O3/c1-29-19-7-5-15(12-23-19)18-8-9-22-21(25-18)24-17-6-4-13-2-3-14(20(27)26-28)10-16(13)11-17/h2-3,5,7-10,12,17,28H,4,6,11H2,1H3,(H,26,27)(H,22,24,25)	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	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120960 (US8716285, 17) Show SMILES Cc1ccc(c(F)c1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C22H21FN4O2/c1-13-2-7-18(19(23)10-13)20-8-9-24-22(26-20)25-17-6-5-14-3-4-15(21(28)27-29)11-16(14)12-17/h2-4,7-11,17,29H,5-6,12H2,1H3,(H,27,28)(H,24,25,26)	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	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121005 (US8716285, 62) Show SMILES ONC(=O)c1ccc2NCC(Cc2c1)NS(=O)(=O)c1cccc(F)c1 Show InChI InChI=1S/C16H16FN3O4S/c17-12-2-1-3-14(8-12)25(23,24)20-13-7-11-6-10(16(21)19-22)4-5-15(11)18-9-13/h1-6,8,13,18,20,22H,7,9H2,(H,19,21)	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	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121007 (US8716285, 64) Show SMILES COc1ccc(cc1OC)S(=O)(=O)NC1CNc2ccc(cc2C1)C(=O)NO Show InChI InChI=1S/C18H21N3O6S/c1-26-16-6-4-14(9-17(16)27-2)28(24,25)21-13-8-12-7-11(18(22)20-23)3-5-15(12)19-10-13/h3-7,9,13,19,21,23H,8,10H2,1-2H3,(H,20,22)	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	1.22E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120961 (US8716285, 18) Show SMILES COc1ccc(c(OC)c1)-c1ccnc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C23H24N4O4/c1-30-18-7-8-19(21(13-18)31-2)20-9-10-24-23(26-20)25-17-6-5-14-3-4-15(22(28)27-29)11-16(14)12-17/h3-4,7-11,13,17,29H,5-6,12H2,1-2H3,(H,27,28)(H,24,25,26)	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	1.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120981 (US8716285, 38) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)NC(=O)OCc1cccnc1 Show InChI InChI=1S/C18H19N3O4/c22-17(21-24)14-4-3-13-5-6-16(9-15(13)8-14)20-18(23)25-11-12-2-1-7-19-10-12/h1-4,7-8,10,16,24H,5-6,9,11H2,(H,20,23)(H,21,22)	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	1.27E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120994 (US8716285, 51) Show SMILES ONC(=O)c1cc2CC(CCc2cc1F)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C17H16ClFN2O4S/c18-12-2-5-14(6-3-12)26(24,25)21-13-4-1-10-9-16(19)15(17(22)20-23)8-11(10)7-13/h2-3,5-6,8-9,13,21,23H,1,4,7H2,(H,20,22)	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	1.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120966 (US8716285, 23) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C27H24N4O3/c32-26(31-33)20-7-6-18-8-11-22(17-21(18)16-20)29-27-28-15-14-25(30-27)19-9-12-24(13-10-19)34-23-4-2-1-3-5-23/h1-7,9-10,12-16,22,33H,8,11,17H2,(H,31,32)(H,28,29,30)	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	1.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121003 (US8716285, 60) Show SMILES ONC(=O)c1ccc2NCC(Cc2c1)NS(=O)(=O)c1ccc(Cl)cc1 Show InChI InChI=1S/C16H16ClN3O4S/c17-12-2-4-14(5-3-12)25(23,24)20-13-8-11-7-10(16(21)19-22)1-6-15(11)18-9-13/h1-7,13,18,20,22H,8-9H2,(H,19,21)	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	1.46E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120975 (US8716285, 32) Show SMILES Cc1cc(Oc2ccccc2)nc(NC2CCc3ccc(cc3C2)C(=O)NO)n1 Show InChI InChI=1S/C22H22N4O3/c1-14-11-20(29-19-5-3-2-4-6-19)25-22(23-14)24-18-10-9-15-7-8-16(21(27)26-28)12-17(15)13-18/h2-8,11-12,18,28H,9-10,13H2,1H3,(H,26,27)(H,23,24,25)	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	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120993 (US8716285, 50) Show SMILES ONC(=O)c1cc2CC(CCc2cc1F)Nc1nccc(n1)-c1cccnc1 Show InChI InChI=1S/C20H18FN5O2/c21-17-10-12-3-4-15(8-14(12)9-16(17)19(27)26-28)24-20-23-7-5-18(25-20)13-2-1-6-22-11-13/h1-2,5-7,9-11,15,28H,3-4,8H2,(H,26,27)(H,23,24,25)	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	1.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120963 (US8716285, 20) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(Cl)cc1Cl Show InChI InChI=1S/C21H18Cl2N4O2/c22-15-4-6-17(18(23)11-15)19-7-8-24-21(26-19)25-16-5-3-12-1-2-13(20(28)27-29)9-14(12)10-16/h1-2,4,6-9,11,16,29H,3,5,10H2,(H,27,28)(H,24,25,26)	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	1.52E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM121006 (US8716285, 63) Show SMILES ONC(=O)c1ccc2NCC(Cc2c1)NS(=O)(=O)c1cccc(OC(F)(F)F)c1 Show InChI InChI=1S/C17H16F3N3O5S/c18-17(19,20)28-13-2-1-3-14(8-13)29(26,27)23-12-7-11-6-10(16(24)22-25)4-5-15(11)21-9-12/h1-6,8,12,21,23,25H,7,9H2,(H,22,24)	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	1.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120957 (US8716285, 14) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1cccc(Cl)c1 Show InChI InChI=1S/C21H19ClN4O2/c22-17-3-1-2-14(11-17)19-8-9-23-21(25-19)24-18-7-6-13-4-5-15(20(27)26-28)10-16(13)12-18/h1-5,8-11,18,28H,6-7,12H2,(H,26,27)(H,23,24,25)	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	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120962 (US8716285, 19) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C22H19F3N4O2/c23-22(24,25)17-6-3-14(4-7-17)19-9-10-26-21(28-19)27-18-8-5-13-1-2-15(20(30)29-31)11-16(13)12-18/h1-4,6-7,9-11,18,31H,5,8,12H2,(H,29,30)(H,26,27,28)	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	1.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120978 (US8716285, 35) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1ncc2cc(F)ccc2n1 Show InChI InChI=1S/C19H17FN4O2/c20-15-4-6-17-14(8-15)10-21-19(23-17)22-16-5-3-11-1-2-12(18(25)24-26)7-13(11)9-16/h1-2,4,6-8,10,16,26H,3,5,9H2,(H,24,25)(H,21,22,23)	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	1.78E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair
Histone deacetylase 8 (Homo sapiens (Human))	BDBM120953 (US8716285, 10) Show SMILES ONC(=O)c1ccc2CCC(Cc2c1)Nc1nccc(n1)-c1ccccc1 Show InChI InChI=1S/C21H20N4O2/c26-20(25-27)16-7-6-14-8-9-18(13-17(14)12-16)23-21-22-11-10-19(24-21)15-4-2-1-3-5-15/h1-7,10-12,18,27H,8-9,13H2,(H,25,26)(H,22,23,24)	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	2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Compounds were tested for their ability to inhibit histone deacetylase 8 using an in vitro deacetylation assay. In a detailed procedure, 8 μl o...				US Patent US8716285 (2014) BindingDB Entry DOI: 10.7270/Q2K072XG
					More data for this Ligand-Target Pair

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