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Compile Data Set for Download or QSAR

Found 353 hits with Last Name = 'cini' and Initial = 'e'   
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))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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n/an/a 2n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 3n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50042849
PNG
(CHEMBL3098695)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C18H24N4O5/c23-15(22-27)10-6-2-5-9-13(21-18(26)14-11-16(24)20-14)17(25)19-12-7-3-1-4-8-12/h1,3-4,7-8,13-14,27H,2,5-6,9-11H2,(H,19,25)(H,20,24)(H,21,26)(H,22,23)/t13-,14-/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495078
PNG
(CHEMBL3098694)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1C(CNC1=O)c1ccccc1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C25H30N4O5/c30-21(29-34)15-9-3-8-14-20(23(31)27-18-12-6-2-7-13-18)28-25(33)22-19(16-26-24(22)32)17-10-4-1-5-11-17/h1-2,4-7,10-13,19-20,22,34H,3,8-9,14-16H2,(H,26,32)(H,27,31)(H,28,33)(H,29,30)/t19?,20-,22?/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495082
PNG
(CHEMBL3098693)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1CCNC1=O)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16(23-28)10-6-2-5-9-15(19(27)21-13-7-3-1-4-8-13)22-18(26)14-11-12-20-17(14)25/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,25)(H,21,27)(H,22,26)(H,23,24)/t14?,15-/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495084
PNG
(CHEMBL3098606)
Show SMILES Cc1ccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)cc1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-7-9-14(10-8-13)21-19(27)15(5-3-2-4-6-18(26)24-29)23-20(28)16-11-12-17(25)22-16/h7-10,15-16,29H,2-6,11-12H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495087
PNG
(CHEMBL3098689)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17-13-7-11-15(22-17)20(28)23-16(10-5-2-6-12-18(26)24-29)19(27)21-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16-/m0/s1
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n/an/a 5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495076
PNG
(CHEMBL3098688)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)NCCc1ccccc1 |r|
Show InChI InChI=1S/C21H30N4O5/c26-18-12-11-17(23-18)21(29)24-16(9-5-2-6-10-19(27)25-30)20(28)22-14-13-15-7-3-1-4-8-15/h1,3-4,7-8,16-17,30H,2,5-6,9-14H2,(H,22,28)(H,23,26)(H,24,29)(H,25,27)/t16-,17+/m0/s1
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n/an/a 6n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495088
PNG
(CHEMBL1089495)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C15H19F3N2O3/c16-15(17,18)11-6-5-7-12(10-11)19-13(21)8-3-1-2-4-9-14(22)20-23/h5-7,10,23H,1-4,8-9H2,(H,19,21)(H,20,22)
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n/an/a 6n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50042848
PNG
(CHEMBL3098691)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15-/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 7n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495083
PNG
(CHEMBL3098687)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)NCCc1ccccc1 |r|
Show InChI InChI=1S/C22H32N4O5/c27-19-13-7-11-18(24-19)22(30)25-17(10-5-2-6-12-20(28)26-31)21(29)23-15-14-16-8-3-1-4-9-16/h1,3-4,8-9,17-18,31H,2,5-7,10-15H2,(H,23,29)(H,24,27)(H,25,30)(H,26,28)/t17-,18-/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495077
PNG
(CHEMBL3098690)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15+/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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n/an/a 8n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC10 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 11n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495079
PNG
(CHEMBL3098605)
Show SMILES Cc1ccc(NC(=O)CCCCCCC(=O)NO)cc1
Show InChI InChI=1S/C15H22N2O3/c1-12-8-10-13(11-9-12)16-14(18)6-4-2-3-5-7-15(19)17-20/h8-11,20H,2-7H2,1H3,(H,16,18)(H,17,19)
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n/an/a 12n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50495078
PNG
(CHEMBL3098694)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1C(CNC1=O)c1ccccc1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C25H30N4O5/c30-21(29-34)15-9-3-8-14-20(23(31)27-18-12-6-2-7-13-18)28-25(33)22-19(16-26-24(22)32)17-10-4-1-5-11-17/h1-2,4-7,10-13,19-20,22,34H,3,8-9,14-16H2,(H,26,32)(H,27,31)(H,28,33)(H,29,30)/t19?,20-,22?/m0/s1
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n/an/a 14n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 16n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495080
PNG
(CHEMBL3098692)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1CCCNC1=O)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17(24-29)12-6-2-5-11-16(20(28)22-14-8-3-1-4-9-14)23-19(27)15-10-7-13-21-18(15)26/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,26)(H,22,28)(H,23,27)(H,24,25)/t15?,16-/m0/s1
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n/an/a 19n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 9


(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 20n/an/an/an/an/an/a



Universita` degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC9 using ArgHisLysLys(Ac) fluorogenic peptide as a substrate by fluorimetric assay


J Med Chem 54: 2165-82 (2011)


Article DOI: 10.1021/jm101373a
BindingDB Entry DOI: 10.7270/Q2CR5TNZ
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50495087
PNG
(CHEMBL3098689)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17-13-7-11-15(22-17)20(28)23-16(10-5-2-6-12-18(26)24-29)19(27)21-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16-/m0/s1
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n/an/a 20n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495081
PNG
(CHEMBL3098603)
Show SMILES Cc1cccc(NC(=O)CCCCCCC(=O)NO)c1
Show InChI InChI=1S/C15H22N2O3/c1-12-7-6-8-13(11-12)16-14(18)9-4-2-3-5-10-15(19)17-20/h6-8,11,20H,2-5,9-10H2,1H3,(H,16,18)(H,17,19)
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n/an/a 22n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50495087
PNG
(CHEMBL3098689)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17-13-7-11-15(22-17)20(28)23-16(10-5-2-6-12-18(26)24-29)19(27)21-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16-/m0/s1
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n/an/a 25n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495085
PNG
(CHEMBL483477)
Show SMILES ONC(=O)CCCCCCC(=O)NCCc1ccccc1
Show InChI InChI=1S/C16H24N2O3/c19-15(10-6-1-2-7-11-16(20)18-21)17-13-12-14-8-4-3-5-9-14/h3-5,8-9,21H,1-2,6-7,10-13H2,(H,17,19)(H,18,20)
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n/an/a 25n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
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 29n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 30n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC10 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50495086
PNG
(CHEMBL3098697)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)NC1CCCC1 |r|
Show InChI InChI=1S/C19H32N4O5/c24-16-12-6-10-14(21-16)19(27)22-15(9-2-1-3-11-17(25)23-28)18(26)20-13-7-4-5-8-13/h13-15,28H,1-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15-/m0/s1
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n/an/a 31n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC6 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50495084
PNG
(CHEMBL3098606)
Show SMILES Cc1ccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)cc1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-7-9-14(10-8-13)21-19(27)15(5-3-2-4-6-18(26)24-29)23-20(28)16-11-12-17(25)22-16/h7-10,15-16,29H,2-6,11-12H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50495076
PNG
(CHEMBL3098688)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)NCCc1ccccc1 |r|
Show InChI InChI=1S/C21H30N4O5/c26-18-12-11-17(23-18)21(29)24-16(9-5-2-6-10-19(27)25-30)20(28)22-14-13-15-7-3-1-4-8-15/h1,3-4,7-8,16-17,30H,2,5-6,9-14H2,(H,22,28)(H,23,26)(H,24,29)(H,25,27)/t16-,17+/m0/s1
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n/an/a 32n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC8 using RHK(Ac)K(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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n/an/a 33n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC8 using RHK(Ac)K(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50495078
PNG
(CHEMBL3098694)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1C(CNC1=O)c1ccccc1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C25H30N4O5/c30-21(29-34)15-9-3-8-14-20(23(31)27-18-12-6-2-7-13-18)28-25(33)22-19(16-26-24(22)32)17-10-4-1-5-11-17/h1-2,4-7,10-13,19-20,22,34H,3,8-9,14-16H2,(H,26,32)(H,27,31)(H,28,33)(H,29,30)/t19?,20-,22?/m0/s1
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n/an/a 33n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50042849
PNG
(CHEMBL3098695)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C18H24N4O5/c23-15(22-27)10-6-2-5-9-13(21-18(26)14-11-16(24)20-14)17(25)19-12-7-3-1-4-8-12/h1,3-4,7-8,13-14,27H,2,5-6,9-11H2,(H,19,25)(H,20,24)(H,21,26)(H,22,23)/t13-,14-/m0/s1
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n/an/a 34n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50042848
PNG
(CHEMBL3098691)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15-/m0/s1
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n/an/a 37n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50495077
PNG
(CHEMBL3098690)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15+/m0/s1
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n/an/a 43n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50495087
PNG
(CHEMBL3098689)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17-13-7-11-15(22-17)20(28)23-16(10-5-2-6-12-18(26)24-29)19(27)21-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16-/m0/s1
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n/an/a 47n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50495076
PNG
(CHEMBL3098688)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)NCCc1ccccc1 |r|
Show InChI InChI=1S/C21H30N4O5/c26-18-12-11-17(23-18)21(29)24-16(9-5-2-6-10-19(27)25-30)20(28)22-14-13-15-7-3-1-4-8-15/h1,3-4,7-8,16-17,30H,2,5-6,9-14H2,(H,22,28)(H,23,26)(H,24,29)(H,25,27)/t16-,17+/m0/s1
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n/an/a 48n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM50495087
PNG
(CHEMBL3098689)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C20H28N4O5/c25-17-13-7-11-15(22-17)20(28)23-16(10-5-2-6-12-18(26)24-29)19(27)21-14-8-3-1-4-9-14/h1,3-4,8-9,15-16,29H,2,5-7,10-13H2,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16-/m0/s1
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n/an/a 51n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC10 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50042846
PNG
(CHEMBL3098604)
Show SMILES Cc1cccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)c1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-6-5-7-14(12-13)21-19(27)15(8-3-2-4-9-18(26)24-29)23-20(28)16-10-11-17(25)22-16/h5-7,12,15-16,29H,2-4,8-11H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 52n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC8 using RHK(Ac)K(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50042847
PNG
(CHEMBL3098602)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C20H25F3N4O5/c21-20(22,23)12-5-4-6-13(11-12)24-18(30)14(7-2-1-3-8-17(29)27-32)26-19(31)15-9-10-16(28)25-15/h4-6,11,14-15,32H,1-3,7-10H2,(H,24,30)(H,25,28)(H,26,31)(H,27,29)/t14-,15+/m0/s1
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n/an/a 56n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50042848
PNG
(CHEMBL3098691)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15-/m0/s1
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n/an/a 59n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
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 61n/an/an/an/an/an/a



Universita` degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using ArgHisLysLys(Ac) fluorogenic peptide as a substrate by fluorimetric assay


J Med Chem 54: 2165-82 (2011)


Article DOI: 10.1021/jm101373a
BindingDB Entry DOI: 10.7270/Q2CR5TNZ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50042849
PNG
(CHEMBL3098695)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@@H]1CC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C18H24N4O5/c23-15(22-27)10-6-2-5-9-13(21-18(26)14-11-16(24)20-14)17(25)19-12-7-3-1-4-8-12/h1,3-4,7-8,13-14,27H,2,5-6,9-11H2,(H,19,25)(H,20,24)(H,21,26)(H,22,23)/t13-,14-/m0/s1
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n/an/a 62n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM50495088
PNG
(CHEMBL1089495)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C15H19F3N2O3/c16-15(17,18)11-6-5-7-12(10-11)19-13(21)8-3-1-2-4-9-14(22)20-23/h5-7,10,23H,1-4,8-9H2,(H,19,21)(H,20,22)
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n/an/a 63n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC1 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50495084
PNG
(CHEMBL3098606)
Show SMILES Cc1ccc(NC(=O)[C@H](CCCCCC(=O)NO)NC(=O)[C@H]2CCC(=O)N2)cc1 |r|
Show InChI InChI=1S/C20H28N4O5/c1-13-7-9-14(10-8-13)21-19(27)15(5-3-2-4-6-18(26)24-29)23-20(28)16-11-12-17(25)22-16/h7-10,15-16,29H,2-6,11-12H2,1H3,(H,21,27)(H,22,25)(H,23,28)(H,24,26)/t15-,16+/m0/s1
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n/an/a 66n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 3/Nuclear receptor corepressor 2 (HDAC3/NCoR2)


(Homo sapiens (Human))
BDBM50495077
PNG
(CHEMBL3098690)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C19H26N4O5/c24-16-12-11-15(21-16)19(27)22-14(9-5-2-6-10-17(25)23-28)18(26)20-13-7-3-1-4-8-13/h1,3-4,7-8,14-15,28H,2,5-6,9-12H2,(H,20,26)(H,21,24)(H,22,27)(H,23,25)/t14-,15+/m0/s1
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n/an/a 67n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC3/NCOR2 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50495078
PNG
(CHEMBL3098694)
Show SMILES ONC(=O)CCCCC[C@H](NC(=O)C1C(CNC1=O)c1ccccc1)C(=O)Nc1ccccc1 |r|
Show InChI InChI=1S/C25H30N4O5/c30-21(29-34)15-9-3-8-14-20(23(31)27-18-12-6-2-7-13-18)28-25(33)22-19(16-26-24(22)32)17-10-4-1-5-11-17/h1-2,4-7,10-13,19-20,22,34H,3,8-9,14-16H2,(H,26,32)(H,27,31)(H,28,33)(H,29,30)/t19?,20-,22?/m0/s1
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n/an/a 70n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human HDAC11 using RHKK(Ac) as substrate by fluorimetric analysis


Bioorg Med Chem Lett 24: 61-4 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.072
BindingDB Entry DOI: 10.7270/Q21839GT
More data for this
Ligand-Target Pair
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