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PubMed code 19419863

Compile data set for download or QSAR
Found 58 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258645
PNG
(CHEMBL511212 | N1-hydroxy-N8-(4-phenylthiazol-2-yl...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C17H21N3O3S/c21-15(10-6-1-2-7-11-16(22)20-23)19-17-18-14(12-24-17)13-8-4-3-5-9-13/h3-5,8-9,12,23H,1-2,6-7,10-11H2,(H,20,22)(H,18,19,21)
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n/an/a 3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258645
PNG
(CHEMBL511212 | N1-hydroxy-N8-(4-phenylthiazol-2-yl...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C17H21N3O3S/c21-15(10-6-1-2-7-11-16(22)20-23)19-17-18-14(12-24-17)13-8-4-3-5-9-13/h3-5,8-9,12,23H,1-2,6-7,10-11H2,(H,20,22)(H,18,19,21)
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n/an/a 3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258646
PNG
(CHEMBL468935 | N1-(4-(3-aminophenyl)thiazol-2-yl)-...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCCCC(=O)NO)n1
Show InChI InChI=1S/C17H22N4O3S/c18-13-7-5-6-12(10-13)14-11-25-17(19-14)20-15(22)8-3-1-2-4-9-16(23)21-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,21,23)(H,19,20,22)
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n/an/a 3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258646
PNG
(CHEMBL468935 | N1-(4-(3-aminophenyl)thiazol-2-yl)-...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCCCC(=O)NO)n1
Show InChI InChI=1S/C17H22N4O3S/c18-13-7-5-6-12(10-13)14-11-25-17(19-14)20-15(22)8-3-1-2-4-9-16(23)21-24/h5-7,10-11,24H,1-4,8-9,18H2,(H,21,23)(H,19,20,22)
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n/an/a 4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258647
PNG
(CHEMBL512644 | N1-(biphenyl-4-yl)-N8-hydroxyoctane...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H24N2O3/c23-19(10-6-1-2-7-11-20(24)22-25)21-18-14-12-17(13-15-18)16-8-4-3-5-9-16/h3-5,8-9,12-15,25H,1-2,6-7,10-11H2,(H,21,23)(H,22,24)
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n/an/a 5n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258647
PNG
(CHEMBL512644 | N1-(biphenyl-4-yl)-N8-hydroxyoctane...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H24N2O3/c23-19(10-6-1-2-7-11-20(24)22-25)21-18-14-12-17(13-15-18)16-8-4-3-5-9-16/h3-5,8-9,12-15,25H,1-2,6-7,10-11H2,(H,21,23)(H,22,24)
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n/an/a 7n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM19149
PNG
(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)
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n/an/a 14n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM19149
PNG
(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)
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n/an/a 17n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258649
PNG
(5-(5-(4-(3-aminophenyl)thiazol-2-ylamino)-5-oxopen...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCc2cc(no2)C(=O)NO)n1
Show InChI InChI=1S/C18H19N5O4S/c19-12-5-3-4-11(8-12)15-10-28-18(20-15)21-16(24)7-2-1-6-13-9-14(23-27-13)17(25)22-26/h3-5,8-10,26H,1-2,6-7,19H2,(H,22,25)(H,20,21,24)
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n/an/a 25n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258648
PNG
(CHEMBL469134 | N-hydroxy-5-(5-oxo-5-(4-phenylthiaz...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O4S/c23-16(9-5-4-8-13-10-14(22-26-13)17(24)21-25)20-18-19-15(11-27-18)12-6-2-1-3-7-12/h1-3,6-7,10-11,25H,4-5,8-9H2,(H,21,24)(H,19,20,23)
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n/an/a 30n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258647
PNG
(CHEMBL512644 | N1-(biphenyl-4-yl)-N8-hydroxyoctane...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H24N2O3/c23-19(10-6-1-2-7-11-20(24)22-25)21-18-14-12-17(13-15-18)16-8-4-3-5-9-16/h3-5,8-9,12-15,25H,1-2,6-7,10-11H2,(H,21,23)(H,22,24)
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n/an/a 33n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258685
PNG
(CHEMBL511715 | N-hydroxy-5-(5-oxo-5-(quinolin-3-yl...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2cnc3ccccc3c2)on1
Show InChI InChI=1S/C18H18N4O4/c23-17(20-13-9-12-5-1-3-7-15(12)19-11-13)8-4-2-6-14-10-16(22-26-14)18(24)21-25/h1,3,5,7,9-11,25H,2,4,6,8H2,(H,20,23)(H,21,24)
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n/an/a 51n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258648
PNG
(CHEMBL469134 | N-hydroxy-5-(5-oxo-5-(4-phenylthiaz...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O4S/c23-16(9-5-4-8-13-10-14(22-26-13)17(24)21-25)20-18-19-15(11-27-18)12-6-2-1-3-7-12/h1-3,6-7,10-11,25H,4-5,8-9H2,(H,21,24)(H,19,20,23)
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n/an/a 68n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM19149
PNG
(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)
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n/an/a 72n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258649
PNG
(5-(5-(4-(3-aminophenyl)thiazol-2-ylamino)-5-oxopen...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCc2cc(no2)C(=O)NO)n1
Show InChI InChI=1S/C18H19N5O4S/c19-12-5-3-4-11(8-12)15-10-28-18(20-15)21-16(24)7-2-1-6-13-9-14(23-27-13)17(25)22-26/h3-5,8-10,26H,1-2,6-7,19H2,(H,22,25)(H,20,21,24)
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n/an/a 82n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM19149
PNG
(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)
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n/an/a 96n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258685
PNG
(CHEMBL511715 | N-hydroxy-5-(5-oxo-5-(quinolin-3-yl...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2cnc3ccccc3c2)on1
Show InChI InChI=1S/C18H18N4O4/c23-17(20-13-9-12-5-1-3-7-15(12)19-11-13)8-4-2-6-14-10-16(22-26-14)18(24)21-25/h1,3,5,7,9-11,25H,2,4,6,8H2,(H,20,23)(H,21,24)
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n/an/a 102n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258649
PNG
(5-(5-(4-(3-aminophenyl)thiazol-2-ylamino)-5-oxopen...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCc2cc(no2)C(=O)NO)n1
Show InChI InChI=1S/C18H19N5O4S/c19-12-5-3-4-11(8-12)15-10-28-18(20-15)21-16(24)7-2-1-6-13-9-14(23-27-13)17(25)22-26/h3-5,8-10,26H,1-2,6-7,19H2,(H,22,25)(H,20,21,24)
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n/an/a 139n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258649
PNG
(5-(5-(4-(3-aminophenyl)thiazol-2-ylamino)-5-oxopen...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCc2cc(no2)C(=O)NO)n1
Show InChI InChI=1S/C18H19N5O4S/c19-12-5-3-4-11(8-12)15-10-28-18(20-15)21-16(24)7-2-1-6-13-9-14(23-27-13)17(25)22-26/h3-5,8-10,26H,1-2,6-7,19H2,(H,22,25)(H,20,21,24)
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n/an/a 164n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258649
PNG
(5-(5-(4-(3-aminophenyl)thiazol-2-ylamino)-5-oxopen...)
Show SMILES Nc1cccc(c1)-c1csc(NC(=O)CCCCc2cc(no2)C(=O)NO)n1
Show InChI InChI=1S/C18H19N5O4S/c19-12-5-3-4-11(8-12)15-10-28-18(20-15)21-16(24)7-2-1-6-13-9-14(23-27-13)17(25)22-26/h3-5,8-10,26H,1-2,6-7,19H2,(H,22,25)(H,20,21,24)
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n/an/a 250n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258648
PNG
(CHEMBL469134 | N-hydroxy-5-(5-oxo-5-(4-phenylthiaz...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O4S/c23-16(9-5-4-8-13-10-14(22-26-13)17(24)21-25)20-18-19-15(11-27-18)12-6-2-1-3-7-12/h1-3,6-7,10-11,25H,4-5,8-9H2,(H,21,24)(H,19,20,23)
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n/an/a 254n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM19149
PNG
(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)
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n/an/a 282n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258648
PNG
(CHEMBL469134 | N-hydroxy-5-(5-oxo-5-(4-phenylthiaz...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O4S/c23-16(9-5-4-8-13-10-14(22-26-13)17(24)21-25)20-18-19-15(11-27-18)12-6-2-1-3-7-12/h1-3,6-7,10-11,25H,4-5,8-9H2,(H,21,24)(H,19,20,23)
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n/an/a 303n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258685
PNG
(CHEMBL511715 | N-hydroxy-5-(5-oxo-5-(quinolin-3-yl...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2cnc3ccccc3c2)on1
Show InChI InChI=1S/C18H18N4O4/c23-17(20-13-9-12-5-1-3-7-15(12)19-11-13)8-4-2-6-14-10-16(22-26-14)18(24)21-25/h1,3,5,7,9-11,25H,2,4,6,8H2,(H,20,23)(H,21,24)
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n/an/a 328n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258648
PNG
(CHEMBL469134 | N-hydroxy-5-(5-oxo-5-(4-phenylthiaz...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O4S/c23-16(9-5-4-8-13-10-14(22-26-13)17(24)21-25)20-18-19-15(11-27-18)12-6-2-1-3-7-12/h1-3,6-7,10-11,25H,4-5,8-9H2,(H,21,24)(H,19,20,23)
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n/an/a 430n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258685
PNG
(CHEMBL511715 | N-hydroxy-5-(5-oxo-5-(quinolin-3-yl...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2cnc3ccccc3c2)on1
Show InChI InChI=1S/C18H18N4O4/c23-17(20-13-9-12-5-1-3-7-15(12)19-11-13)8-4-2-6-14-10-16(22-26-14)18(24)21-25/h1,3,5,7,9-11,25H,2,4,6,8H2,(H,20,23)(H,21,24)
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n/an/a 469n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258685
PNG
(CHEMBL511715 | N-hydroxy-5-(5-oxo-5-(quinolin-3-yl...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2cnc3ccccc3c2)on1
Show InChI InChI=1S/C18H18N4O4/c23-17(20-13-9-12-5-1-3-7-15(12)19-11-13)8-4-2-6-14-10-16(22-26-14)18(24)21-25/h1,3,5,7,9-11,25H,2,4,6,8H2,(H,20,23)(H,21,24)
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n/an/a 471n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258686
PNG
(5-(5-(biphenyl-4-ylamino)-5-oxopentyl)-N-hydroxyis...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2ccc(cc2)-c2ccccc2)on1
Show InChI InChI=1S/C21H21N3O4/c25-20(9-5-4-8-18-14-19(24-28-18)21(26)23-27)22-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-3,6-7,10-14,27H,4-5,8-9H2,(H,22,25)(H,23,26)
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n/an/a 885n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258686
PNG
(5-(5-(biphenyl-4-ylamino)-5-oxopentyl)-N-hydroxyis...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2ccc(cc2)-c2ccccc2)on1
Show InChI InChI=1S/C21H21N3O4/c25-20(9-5-4-8-18-14-19(24-28-18)21(26)23-27)22-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-3,6-7,10-14,27H,4-5,8-9H2,(H,22,25)(H,23,26)
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n/an/a 885n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258720
PNG
(CHEMBL466459 | tert-butyl 4-(3-(2-(4-(3-(hydroxyca...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NO
Show InChI InChI=1S/C27H26N6O8/c1-27(2,3)39-26(37)30-18-10-6-16(7-11-18)21-12-19(32-40-21)24(35)28-14-23(34)29-17-8-4-15(5-9-17)22-13-20(33-41-22)25(36)31-38/h4-13,38H,14H2,1-3H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)
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n/an/a 920n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258720
PNG
(CHEMBL466459 | tert-butyl 4-(3-(2-(4-(3-(hydroxyca...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NO
Show InChI InChI=1S/C27H26N6O8/c1-27(2,3)39-26(37)30-18-10-6-16(7-11-18)21-12-19(32-40-21)24(35)28-14-23(34)29-17-8-4-15(5-9-17)22-13-20(33-41-22)25(36)31-38/h4-13,38H,14H2,1-3H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)
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n/an/a 1.71E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258720
PNG
(CHEMBL466459 | tert-butyl 4-(3-(2-(4-(3-(hydroxyca...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NO
Show InChI InChI=1S/C27H26N6O8/c1-27(2,3)39-26(37)30-18-10-6-16(7-11-18)21-12-19(32-40-21)24(35)28-14-23(34)29-17-8-4-15(5-9-17)22-13-20(33-41-22)25(36)31-38/h4-13,38H,14H2,1-3H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)
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n/an/a 1.92E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258686
PNG
(5-(5-(biphenyl-4-ylamino)-5-oxopentyl)-N-hydroxyis...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2ccc(cc2)-c2ccccc2)on1
Show InChI InChI=1S/C21H21N3O4/c25-20(9-5-4-8-18-14-19(24-28-18)21(26)23-27)22-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-3,6-7,10-14,27H,4-5,8-9H2,(H,22,25)(H,23,26)
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n/an/a 3.75E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258686
PNG
(5-(5-(biphenyl-4-ylamino)-5-oxopentyl)-N-hydroxyis...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)Nc2ccc(cc2)-c2ccccc2)on1
Show InChI InChI=1S/C21H21N3O4/c25-20(9-5-4-8-18-14-19(24-28-18)21(26)23-27)22-17-12-10-16(11-13-17)15-6-2-1-3-7-15/h1-3,6-7,10-14,27H,4-5,8-9H2,(H,22,25)(H,23,26)
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n/an/a 7.41E+3n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258683
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES OC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H17N3O4S/c22-16(9-5-4-8-13-10-14(17(23)24)21-25-13)20-18-19-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,23,24)(H,19,20,22)
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n/an/a 1.06E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258719
PNG
(5-(5-(cyclohexylamino)-5-oxopentyl)-N-hydroxyisoxa...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCCC2)on1
Show InChI InChI=1S/C15H23N3O4/c19-14(16-11-6-2-1-3-7-11)9-5-4-8-12-10-13(18-22-12)15(20)17-21/h10-11,21H,1-9H2,(H,16,19)(H,17,20)
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n/an/a 1.23E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258719
PNG
(5-(5-(cyclohexylamino)-5-oxopentyl)-N-hydroxyisoxa...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCCC2)on1
Show InChI InChI=1S/C15H23N3O4/c19-14(16-11-6-2-1-3-7-11)9-5-4-8-12-10-13(18-22-12)15(20)17-21/h10-11,21H,1-9H2,(H,16,19)(H,17,20)
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n/an/a 1.23E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258720
PNG
(CHEMBL466459 | tert-butyl 4-(3-(2-(4-(3-(hydroxyca...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NO
Show InChI InChI=1S/C27H26N6O8/c1-27(2,3)39-26(37)30-18-10-6-16(7-11-18)21-12-19(32-40-21)24(35)28-14-23(34)29-17-8-4-15(5-9-17)22-13-20(33-41-22)25(36)31-38/h4-13,38H,14H2,1-3H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)
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n/an/a 1.33E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258718
PNG
(5-(5-(cyclopentylamino)-5-oxopentyl)-N-hydroxyisox...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCC2)on1
Show InChI InChI=1S/C14H21N3O4/c18-13(15-10-5-1-2-6-10)8-4-3-7-11-9-12(17-21-11)14(19)16-20/h9-10,20H,1-8H2,(H,15,18)(H,16,19)
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n/an/a 1.71E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258718
PNG
(5-(5-(cyclopentylamino)-5-oxopentyl)-N-hydroxyisox...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCC2)on1
Show InChI InChI=1S/C14H21N3O4/c18-13(15-10-5-1-2-6-10)8-4-3-7-11-9-12(17-21-11)14(19)16-20/h9-10,20H,1-8H2,(H,15,18)(H,16,19)
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n/an/a 1.71E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258682
PNG
(5-(3-(hydroxymethyl)isoxazol-5-yl)-N-(4-phenylthia...)
Show SMILES OCc1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H19N3O3S/c22-11-14-10-15(24-21-14)8-4-5-9-17(23)20-18-19-16(12-25-18)13-6-2-1-3-7-13/h1-3,6-7,10,12,22H,4-5,8-9,11H2,(H,19,20,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258684
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES NC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O3S/c19-17(24)14-10-13(25-22-14)8-4-5-9-16(23)21-18-20-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,19,24)(H,20,21,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258684
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES NC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O3S/c19-17(24)14-10-13(25-22-14)8-4-5-9-16(23)21-18-20-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,19,24)(H,20,21,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258719
PNG
(5-(5-(cyclohexylamino)-5-oxopentyl)-N-hydroxyisoxa...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCCC2)on1
Show InChI InChI=1S/C15H23N3O4/c19-14(16-11-6-2-1-3-7-11)9-5-4-8-12-10-13(18-22-12)15(20)17-21/h10-11,21H,1-9H2,(H,16,19)(H,17,20)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258719
PNG
(5-(5-(cyclohexylamino)-5-oxopentyl)-N-hydroxyisoxa...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCCC2)on1
Show InChI InChI=1S/C15H23N3O4/c19-14(16-11-6-2-1-3-7-11)9-5-4-8-12-10-13(18-22-12)15(20)17-21/h10-11,21H,1-9H2,(H,16,19)(H,17,20)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258684
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES NC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O3S/c19-17(24)14-10-13(25-22-14)8-4-5-9-16(23)21-18-20-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,19,24)(H,20,21,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258683
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES OC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H17N3O4S/c22-16(9-5-4-8-13-10-14(17(23)24)21-25-13)20-18-19-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,23,24)(H,19,20,22)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258720
PNG
(CHEMBL466459 | tert-butyl 4-(3-(2-(4-(3-(hydroxyca...)
Show SMILES CC(C)(C)OC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NCC(=O)Nc1ccc(cc1)-c1cc(no1)C(=O)NO
Show InChI InChI=1S/C27H26N6O8/c1-27(2,3)39-26(37)30-18-10-6-16(7-11-18)21-12-19(32-40-21)24(35)28-14-23(34)29-17-8-4-15(5-9-17)22-13-20(33-41-22)25(36)31-38/h4-13,38H,14H2,1-3H3,(H,28,35)(H,29,34)(H,30,37)(H,31,36)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258683
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES OC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H17N3O4S/c22-16(9-5-4-8-13-10-14(17(23)24)21-25-13)20-18-19-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,23,24)(H,19,20,22)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258684
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES NC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O3S/c19-17(24)14-10-13(25-22-14)8-4-5-9-16(23)21-18-20-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,19,24)(H,20,21,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50258682
PNG
(5-(3-(hydroxymethyl)isoxazol-5-yl)-N-(4-phenylthia...)
Show SMILES OCc1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H19N3O3S/c22-11-14-10-15(24-21-14)8-4-5-9-17(23)20-18-19-16(12-25-18)13-6-2-1-3-7-13/h1-3,6-7,10,12,22H,4-5,8-9,11H2,(H,19,20,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC3


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50258682
PNG
(5-(3-(hydroxymethyl)isoxazol-5-yl)-N-(4-phenylthia...)
Show SMILES OCc1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H19N3O3S/c22-11-14-10-15(24-21-14)8-4-5-9-17(23)20-18-19-16(12-25-18)13-6-2-1-3-7-13/h1-3,6-7,10,12,22H,4-5,8-9,11H2,(H,19,20,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC10


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258683
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES OC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H17N3O4S/c22-16(9-5-4-8-13-10-14(17(23)24)21-25-13)20-18-19-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,23,24)(H,19,20,22)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258718
PNG
(5-(5-(cyclopentylamino)-5-oxopentyl)-N-hydroxyisox...)
Show SMILES ONC(=O)c1cc(CCCCC(=O)NC2CCCC2)on1
Show InChI InChI=1S/C14H21N3O4/c18-13(15-10-5-1-2-6-10)8-4-3-7-11-9-12(17-21-11)14(19)16-20/h9-10,20H,1-8H2,(H,15,18)(H,16,19)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258684
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES NC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H18N4O3S/c19-17(24)14-10-13(25-22-14)8-4-5-9-16(23)21-18-20-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H2,19,24)(H,20,21,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50258682
PNG
(5-(3-(hydroxymethyl)isoxazol-5-yl)-N-(4-phenylthia...)
Show SMILES OCc1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H19N3O3S/c22-11-14-10-15(24-21-14)8-4-5-9-17(23)20-18-19-16(12-25-18)13-6-2-1-3-7-13/h1-3,6-7,10,12,22H,4-5,8-9,11H2,(H,19,20,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC6


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50258682
PNG
(5-(3-(hydroxymethyl)isoxazol-5-yl)-N-(4-phenylthia...)
Show SMILES OCc1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H19N3O3S/c22-11-14-10-15(24-21-14)8-4-5-9-17(23)20-18-19-16(12-25-18)13-6-2-1-3-7-13/h1-3,6-7,10,12,22H,4-5,8-9,11H2,(H,19,20,23)
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n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC2


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50258683
PNG
(5-(5-oxo-5-(4-phenylthiazol-2-ylamino)pentyl)isoxa...)
Show SMILES OC(=O)c1cc(CCCCC(=O)Nc2nc(cs2)-c2ccccc2)on1
Show InChI InChI=1S/C18H17N3O4S/c22-16(9-5-4-8-13-10-14(17(23)24)21-25-13)20-18-19-15(11-26-18)12-6-2-1-3-7-12/h1-3,6-7,10-11H,4-5,8-9H2,(H,23,24)(H,19,20,22)
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UniChem

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Article
PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



University of Illinois at Chicago

Curated by ChEMBL


Assay Description
Inhibition of human recombinant HDAC1


Bioorg Med Chem Lett 19: 3023-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.04.058
BindingDB Entry DOI: 10.7270/Q2833RXG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%