Compile Data Set for Download or QSAR
Found 40 Enz. Inhib. hit(s) with all data for entry = 50031724
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50232053(CHEMBL271741 | N-(4-amino-biphenyl-3-yl)-benzamide...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H16N2O/c20-17-12-11-16(14-7-3-1-4-8-14)13-18(17)21-19(22)15-9-5-2-6-10-15/h1-13H,20H2,(H,21,22)
Affinity DataIC50: 27nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317988(CHEMBL1098337 | N-(4-amino-4'-fluorobiphenyl-3-yl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(F)cc1
Show InChI InChI=1S/C19H15FN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
Affinity DataIC50: 32nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318000(CHEMBL1095095 | N-(2-amino-5-(furan-3-yl)phenyl)be...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccoc1
Show InChI InChI=1S/C17H14N2O2/c18-15-7-6-13(14-8-9-21-11-14)10-16(15)19-17(20)12-4-2-1-3-5-12/h1-11H,18H2,(H,19,20)
Affinity DataIC50: 39nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317996(CHEMBL1097651 | N-(2-amino-5-(furan-2-yl)phenyl)be...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccco1
Show InChI InChI=1S/C17H14N2O2/c18-14-9-8-13(16-7-4-10-21-16)11-15(14)19-17(20)12-5-2-1-3-6-12/h1-11H,18H2,(H,19,20)
Affinity DataIC50: 43nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM19149(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
Affinity DataIC50: 72nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM19149(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
Affinity DataIC50: 76nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317998(CHEMBL1095412 | N-(4-amino-4'-methoxybiphenyl-3-yl...)
Show SMILES COc1ccc(cc1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O2/c1-24-17-10-7-14(8-11-17)16-9-12-18(21)19(13-16)22-20(23)15-5-3-2-4-6-15/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 140nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317999(CHEMBL1095096 | N-(2-amino-5-(pyridin-4-yl)phenyl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccncc1
Show InChI InChI=1S/C18H15N3O/c19-16-7-6-15(13-8-10-20-11-9-13)12-17(16)21-18(22)14-4-2-1-3-5-14/h1-12H,19H2,(H,21,22)
Affinity DataIC50: 270nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318003(CHEMBL1097278 | N-(2-amino-5-(thiazol-2-yl)phenyl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1nccs1
Show InChI InChI=1S/C16H13N3OS/c17-13-7-6-12(16-18-8-9-21-16)10-14(13)19-15(20)11-4-2-1-3-5-11/h1-10H,17H2,(H,19,20)
Affinity DataIC50: 390nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317990(CHEMBL1097748 | N-(4-amino-4'-bromobiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(Br)cc1
Show InChI InChI=1S/C19H15BrN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
Affinity DataIC50: 600nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318002(CHEMBL1096397 | N-(4-amino-4'-vinylbiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(C=C)cc1
Show InChI InChI=1S/C21H18N2O/c1-2-15-8-10-16(11-9-15)18-12-13-19(22)20(14-18)23-21(24)17-6-4-3-5-7-17/h2-14H,1,22H2,(H,23,24)
Affinity DataIC50: 800nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318000(CHEMBL1095095 | N-(2-amino-5-(furan-3-yl)phenyl)be...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccoc1
Show InChI InChI=1S/C17H14N2O2/c18-15-7-6-13(14-8-9-21-11-14)10-16(15)19-17(20)12-4-2-1-3-5-12/h1-11H,18H2,(H,19,20)
Affinity DataIC50: 810nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317998(CHEMBL1095412 | N-(4-amino-4'-methoxybiphenyl-3-yl...)
Show SMILES COc1ccc(cc1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O2/c1-24-17-10-7-14(8-11-17)16-9-12-18(21)19(13-16)22-20(23)15-5-3-2-4-6-15/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 860nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50232053(CHEMBL271741 | N-(4-amino-biphenyl-3-yl)-benzamide...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C19H16N2O/c20-17-12-11-16(14-7-3-1-4-8-14)13-18(17)21-19(22)15-9-5-2-6-10-15/h1-13H,20H2,(H,21,22)
Affinity DataIC50: 900nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317991(CHEMBL1097747 | N-(4-amino-3'-methoxybiphenyl-3-yl...)
Show SMILES COc1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O2/c1-24-17-9-5-8-15(12-17)16-10-11-18(21)19(13-16)22-20(23)14-6-3-2-4-7-14/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 1.30E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317988(CHEMBL1098337 | N-(4-amino-4'-fluorobiphenyl-3-yl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(F)cc1
Show InChI InChI=1S/C19H15FN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
Affinity DataIC50: 1.40E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317996(CHEMBL1097651 | N-(2-amino-5-(furan-2-yl)phenyl)be...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccco1
Show InChI InChI=1S/C17H14N2O2/c18-14-9-8-13(16-7-4-10-21-16)11-15(14)19-17(20)12-5-2-1-3-6-12/h1-11H,18H2,(H,19,20)
Affinity DataIC50: 1.80E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50232046(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
Affinity DataIC50: 3.10E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317995(CHEMBL1094108 | N-(4-amino-3'-methylbiphenyl-3-yl)...)
Show SMILES Cc1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O/c1-14-6-5-9-16(12-14)17-10-11-18(21)19(13-17)22-20(23)15-7-3-2-4-8-15/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 3.10E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317991(CHEMBL1097747 | N-(4-amino-3'-methoxybiphenyl-3-yl...)
Show SMILES COc1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O2/c1-24-17-9-5-8-15(12-17)16-10-11-18(21)19(13-16)22-20(23)14-6-3-2-4-7-14/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 3.40E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317997(CHEMBL1099078 | N-(4'-acetyl-4-aminobiphenyl-3-yl)...)
Show SMILES CC(=O)c1ccc(cc1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H18N2O2/c1-14(24)15-7-9-16(10-8-15)18-11-12-19(22)20(13-18)23-21(25)17-5-3-2-4-6-17/h2-13H,22H2,1H3,(H,23,25)
Affinity DataIC50: 3.80E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317987(CHEMBL1096072 | N-(4-amino-4'-(trifluoromethyl)bip...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H15F3N2O/c21-20(22,23)16-9-6-13(7-10-16)15-8-11-17(24)18(12-15)25-19(26)14-4-2-1-3-5-14/h1-12H,24H2,(H,25,26)
Affinity DataIC50: 3.80E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317999(CHEMBL1095096 | N-(2-amino-5-(pyridin-4-yl)phenyl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccncc1
Show InChI InChI=1S/C18H15N3O/c19-16-7-6-15(13-8-10-20-11-9-13)12-17(16)21-18(22)14-4-2-1-3-5-14/h1-12H,19H2,(H,21,22)
Affinity DataIC50: 3.90E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318002(CHEMBL1096397 | N-(4-amino-4'-vinylbiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(C=C)cc1
Show InChI InChI=1S/C21H18N2O/c1-2-15-8-10-16(11-9-15)18-12-13-19(22)20(14-18)23-21(24)17-6-4-3-5-7-17/h2-14H,1,22H2,(H,23,24)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317997(CHEMBL1099078 | N-(4'-acetyl-4-aminobiphenyl-3-yl)...)
Show SMILES CC(=O)c1ccc(cc1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H18N2O2/c1-14(24)15-7-9-16(10-8-15)18-11-12-19(22)20(13-18)23-21(25)17-5-3-2-4-6-17/h2-13H,22H2,1H3,(H,23,25)
Affinity DataIC50: 5.00E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318003(CHEMBL1097278 | N-(2-amino-5-(thiazol-2-yl)phenyl)...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1nccs1
Show InChI InChI=1S/C16H13N3OS/c17-13-7-6-12(16-18-8-9-21-16)10-14(13)19-15(20)11-4-2-1-3-5-11/h1-10H,17H2,(H,19,20)
Affinity DataIC50: 5.80E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317995(CHEMBL1094108 | N-(4-amino-3'-methylbiphenyl-3-yl)...)
Show SMILES Cc1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O/c1-14-6-5-9-16(12-14)17-10-11-18(21)19(13-17)22-20(23)15-7-3-2-4-8-15/h2-13H,21H2,1H3,(H,22,23)
Affinity DataIC50: 7.20E+3nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317993(CHEMBL1097745 | N-(2-amino-5-(benzo[b]thiophen-3-y...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1csc2ccccc12
Show InChI InChI=1S/C21H16N2OS/c22-18-11-10-15(17-13-25-20-9-5-4-8-16(17)20)12-19(18)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318001(CHEMBL1096398 | N-(2-amino-5-(benzo[b]thiophen-2-y...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cc2ccccc2s1
Show InChI InChI=1S/C21H16N2OS/c22-17-11-10-16(20-13-15-8-4-5-9-19(15)25-20)12-18(17)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317989(CHEMBL1097063 | N-(2-amino-5-(benzofuran-2-yl)phen...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cc2ccccc2o1
Show InChI InChI=1S/C21H16N2O2/c22-17-11-10-16(20-13-15-8-4-5-9-19(15)25-20)12-18(17)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50232046(CHEMBL405072 | N-(2-aminophenyl)benzamide)
Show SMILES Nc1ccccc1NC(=O)c1ccccc1
Show InChI InChI=1S/C13H12N2O/c14-11-8-4-5-9-12(11)15-13(16)10-6-2-1-3-7-10/h1-9H,14H2,(H,15,16)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50318001(CHEMBL1096398 | N-(2-amino-5-(benzo[b]thiophen-2-y...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cc2ccccc2s1
Show InChI InChI=1S/C21H16N2OS/c22-17-11-10-16(20-13-15-8-4-5-9-19(15)25-20)12-18(17)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317989(CHEMBL1097063 | N-(2-amino-5-(benzofuran-2-yl)phen...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cc2ccccc2o1
Show InChI InChI=1S/C21H16N2O2/c22-17-11-10-16(20-13-15-8-4-5-9-19(15)25-20)12-18(17)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317993(CHEMBL1097745 | N-(2-amino-5-(benzo[b]thiophen-3-y...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1csc2ccccc12
Show InChI InChI=1S/C21H16N2OS/c22-18-11-10-15(17-13-25-20-9-5-4-8-16(17)20)12-19(18)23-21(24)14-6-2-1-3-7-14/h1-13H,22H2,(H,23,24)
Affinity DataIC50: 1.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317992(CHEMBL1097746 | N-(3'-acetyl-4-aminobiphenyl-3-yl)...)
Show SMILES CC(=O)c1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H18N2O2/c1-14(24)16-8-5-9-17(12-16)18-10-11-19(22)20(13-18)23-21(25)15-6-3-2-4-7-15/h2-13H,22H2,1H3,(H,23,25)
Affinity DataIC50: 1.30E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317994(CHEMBL1097744 | N-(4-amino-3'-nitrobiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C19H15N3O3/c20-17-10-9-15(14-7-4-8-16(11-14)22(24)25)12-18(17)21-19(23)13-5-2-1-3-6-13/h1-12H,20H2,(H,21,23)
Affinity DataIC50: 2.10E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 24 hrs followed by 1 hr reaction with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317990(CHEMBL1097748 | N-(4-amino-4'-bromobiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(Br)cc1
Show InChI InChI=1S/C19H15BrN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
Affinity DataIC50: 2.40E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317992(CHEMBL1097746 | N-(3'-acetyl-4-aminobiphenyl-3-yl)...)
Show SMILES CC(=O)c1cccc(c1)-c1ccc(N)c(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C21H18N2O2/c1-14(24)16-8-5-9-17(12-16)18-10-11-19(22)20(13-18)23-21(25)15-6-3-2-4-7-15/h2-13H,22H2,1H3,(H,23,25)
Affinity DataIC50: 2.70E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317987(CHEMBL1096072 | N-(4-amino-4'-(trifluoromethyl)bip...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C20H15F3N2O/c21-20(22,23)16-9-6-13(7-10-16)15-8-11-17(24)18(12-15)25-19(26)14-4-2-1-3-5-14/h1-12H,24H2,(H,25,26)
Affinity DataIC50: 4.00E+4nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair
TargetHistone deacetylase 2(Homo sapiens (Human))
Takeda California Inc

Curated by ChEMBL
LigandPNGBDBM50317994(CHEMBL1097744 | N-(4-amino-3'-nitrobiphenyl-3-yl)b...)
Show SMILES Nc1ccc(cc1NC(=O)c1ccccc1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C19H15N3O3/c20-17-10-9-15(14-7-4-8-16(11-14)22(24)25)12-18(17)21-19(23)13-5-2-1-3-6-13/h1-12H,20H2,(H,21,23)
Affinity DataIC50: 2.00E+5nMAssay Description:Inhibition of human recombinant HDAC2 preincubated for 1 hr with substrate by protease coupled end-point assayMore data for this Ligand-Target Pair