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PubMed code 12951120

Compile data set for download or QSAR
Found 32 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
HDACs


(Homo sapiens (human))
BDBM50221964
PNG
(CHEMBL114184)
Show SMILES ONC(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C19H23NO3/c21-19(20-22)10-6-1-2-7-15-23-18-13-11-17(12-14-18)16-8-4-3-5-9-16/h3-5,8-9,11-14,22H,1-2,6-7,10,15H2,(H,20,21)
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n/an/a 0.0200n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221943
PNG
(CHEMBL432618)
Show SMILES COC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H24O4/c1-24-21(23)20(22)11-7-2-3-8-16-25-19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15H,2-3,7-8,11,16H2,1H3
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n/an/a 0.0620n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221809
PNG
(CHEMBL321689)
Show SMILES COC(=O)C(=O)CCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H22O4/c1-23-20(22)19(21)10-6-3-7-15-24-18-13-11-17(12-14-18)16-8-4-2-5-9-16/h2,4-5,8-9,11-14H,3,6-7,10,15H2,1H3
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n/an/a 0.0820n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221786
PNG
(CHEMBL432243)
Show SMILES COC(=O)C(=O)CCCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C22H26O4/c1-25-22(24)21(23)12-8-3-2-4-9-17-26-20-15-13-19(14-16-20)18-10-6-5-7-11-18/h5-7,10-11,13-16H,2-4,8-9,12,17H2,1H3
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n/an/a 0.109n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221965
PNG
(CHEMBL113303)
Show SMILES CNC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H25NO3/c1-22-21(24)20(23)11-7-2-3-8-16-25-19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15H,2-3,7-8,11,16H2,1H3,(H,22,24)
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n/an/a 0.110n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221785
PNG
(CHEMBL112984)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc2CCCCc2c1
Show InChI InChI=1S/C23H29N3O3S/c1-24-22(29)20(27)10-4-2-3-5-11-21(28)26-23-25-19(15-30-23)18-13-12-16-8-6-7-9-17(16)14-18/h12-15H,2-11H2,1H3,(H,24,29)(H,25,26,28)
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n/an/a 1.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50218532
PNG
(CHEMBL112148)
Show SMILES FC(F)(F)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21F3O2/c21-20(22,23)19(24)10-6-1-2-7-15-25-18-13-11-17(12-14-18)16-8-4-3-5-9-16/h3-5,8-9,11-14H,1-2,6-7,10,15H2
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n/an/a 2.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221925
PNG
(CHEMBL113033)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc(CCN(C)C)cc1
Show InChI InChI=1S/C23H32N4O3S/c1-24-22(30)20(28)8-6-4-5-7-9-21(29)26-23-25-19(16-31-23)18-12-10-17(11-13-18)14-15-27(2)3/h10-13,16H,4-9,14-15H2,1-3H3,(H,24,30)(H,25,26,29)
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n/an/a 3.10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221807
PNG
(CHEMBL115049)
Show SMILES OC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H22O4/c21-19(20(22)23)10-6-1-2-7-15-24-18-13-11-17(12-14-18)16-8-4-3-5-9-16/h3-5,8-9,11-14H,1-2,6-7,10,15H2,(H,22,23)
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n/an/a 3.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM25152
PNG
(CHEMBL112446 | N-methyl-2-oxo-N'-(3-phenylphenyl)n...)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C22H26N2O3/c1-23-22(27)20(25)14-7-2-3-8-15-21(26)24-19-13-9-12-18(16-19)17-10-5-4-6-11-17/h4-6,9-13,16H,2-3,7-8,14-15H2,1H3,(H,23,27)(H,24,26)
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n/an/a 3.70n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221814
PNG
(CHEMBL113034)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccncc1
Show InChI InChI=1S/C18H22N4O3S/c1-19-17(25)15(23)6-4-2-3-5-7-16(24)22-18-21-14(12-26-18)13-8-10-20-11-9-13/h8-12H,2-7H2,1H3,(H,19,25)(H,21,22,24)
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n/an/a 4.30n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221938
PNG
(CHEMBL321253)
Show SMILES CCNC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C22H27NO3/c1-2-23-22(25)21(24)12-8-3-4-9-17-26-20-15-13-19(14-16-20)18-10-6-5-7-11-18/h5-7,10-11,13-16H,2-4,8-9,12,17H2,1H3,(H,23,25)
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n/an/a 4.90n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221988
PNG
(CHEMBL113566)
Show SMILES CN(C)C(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C22H27NO3/c1-23(2)22(25)21(24)12-8-3-4-9-17-26-20-15-13-19(14-16-20)18-10-6-5-7-11-18/h5-7,10-11,13-16H,3-4,8-9,12,17H2,1-2H3
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n/an/a>5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50222011
PNG
(CHEMBL324429)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccc(OC)cc1
Show InChI InChI=1S/C20H25N3O4S/c1-21-19(26)17(24)7-5-3-4-6-8-18(25)23-20-22-16(13-28-20)14-9-11-15(27-2)12-10-14/h9-13H,3-8H2,1-2H3,(H,21,26)(H,22,23,25)
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n/an/a 9.10n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221941
PNG
(CHEMBL420300)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1ccc2ccccc2c1
Show InChI InChI=1S/C20H24N2O3/c1-21-20(25)18(23)10-4-2-3-5-11-19(24)22-17-13-12-15-8-6-7-9-16(15)14-17/h6-9,12-14H,2-5,10-11H2,1H3,(H,21,25)(H,22,24)
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n/an/a 9.40n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221810
PNG
(CHEMBL111898)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1cnc2ccccc2c1
Show InChI InChI=1S/C19H23N3O3/c1-20-19(25)17(23)10-4-2-3-5-11-18(24)22-15-12-14-8-6-7-9-16(14)21-13-15/h6-9,12-13H,2-5,10-11H2,1H3,(H,20,25)(H,22,24)
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n/an/a 9.5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221940
PNG
(CHEMBL333150)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc(cs1)-c1ccccc1
Show InChI InChI=1S/C19H23N3O3S/c1-20-18(25)16(23)11-7-2-3-8-12-17(24)22-19-21-15(13-26-19)14-9-5-4-6-10-14/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3,(H,20,25)(H,21,22,24)
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n/an/a 11n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221934
PNG
(CHEMBL113094)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1ccc2cc[nH]c2c1
Show InChI InChI=1S/C18H23N3O3/c1-19-18(24)16(22)6-4-2-3-5-7-17(23)21-14-9-8-13-10-11-20-15(13)12-14/h8-12,20H,2-7H2,1H3,(H,19,24)(H,21,23)
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n/an/a 18n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221962
PNG
(CHEMBL320921)
Show SMILES CNC(=O)C(=O)CCCCCCNC(=O)c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C22H26N2O3/c1-23-22(27)20(25)14-7-2-3-8-15-24-21(26)19-13-9-12-18(16-19)17-10-5-4-6-11-17/h4-6,9-13,16H,2-3,7-8,14-15H2,1H3,(H,23,27)(H,24,26)
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n/an/a 21n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221942
PNG
(CHEMBL113367)
Show SMILES OC(=O)CNC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C22H25NO5/c24-20(22(27)23-16-21(25)26)10-6-1-2-7-15-28-19-13-11-18(12-14-19)17-8-4-3-5-9-17/h3-5,8-9,11-14H,1-2,6-7,10,15-16H2,(H,23,27)(H,25,26)
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n/an/a>50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221783
PNG
(CHEMBL113495)
Show SMILES NC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H23NO3/c21-20(23)19(22)10-6-1-2-7-15-24-18-13-11-17(12-14-18)16-8-4-3-5-9-16/h3-5,8-9,11-14H,1-2,6-7,10,15H2,(H2,21,23)
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n/an/a>50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221811
PNG
(CHEMBL265564)
Show SMILES CN(C)CCNC(=O)C(=O)CCCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C24H32N2O3/c1-26(2)18-17-25-24(28)23(27)12-8-3-4-9-19-29-22-15-13-21(14-16-22)20-10-6-5-7-11-20/h5-7,10-11,13-16H,3-4,8-9,12,17-19H2,1-2H3,(H,25,28)
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n/an/a>50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221963
PNG
(CHEMBL112340)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1nc2ccccc2s1
Show InChI InChI=1S/C17H21N3O3S/c1-18-16(23)13(21)9-4-2-3-5-11-15(22)20-17-19-12-8-6-7-10-14(12)24-17/h6-8,10H,2-5,9,11H2,1H3,(H,18,23)(H,19,20,22)
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n/an/a 133n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221937
PNG
(CHEMBL112742)
Show SMILES CNC(=O)C(=O)CCCCCCS(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H25NO4S/c1-22-21(24)20(23)11-7-2-3-8-16-27(25,26)19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15H,2-3,7-8,11,16H2,1H3,(H,22,24)
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n/an/a 143n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221939
PNG
(CHEMBL444534)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C22H26N2O3/c1-23-22(27)20(25)11-7-2-3-8-12-21(26)24-19-15-13-18(14-16-19)17-9-5-4-6-10-17/h4-6,9-10,13-16H,2-3,7-8,11-12H2,1H3,(H,23,27)(H,24,26)
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n/an/a 201n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221997
PNG
(CHEMBL113093)
Show SMILES CNC(=O)C(=O)CCCCCCNS(=O)(=O)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H26N2O4S/c1-22-21(25)20(24)11-7-2-3-8-16-23-28(26,27)19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15,23H,2-3,7-8,11,16H2,1H3,(H,22,25)
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n/an/a 241n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221784
PNG
(CHEMBL112211)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C16H22N2O3/c1-17-16(21)14(19)11-7-2-3-8-12-15(20)18-13-9-5-4-6-10-13/h4-6,9-10H,2-3,7-8,11-12H2,1H3,(H,17,21)(H,18,20)
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n/an/a 338n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221812
PNG
(CHEMBL113156)
Show SMILES CNC(=O)C(=O)CCCCCCSc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H25NO2S/c1-22-21(24)20(23)11-7-2-3-8-16-25-19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15H,2-3,7-8,11,16H2,1H3,(H,22,24)
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n/an/a 526n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221936
PNG
(CHEMBL112171)
Show SMILES CNC(=O)C(=O)CCCCCO\N=C/c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H24N2O3/c1-22-21(25)20(24)10-6-3-7-15-26-23-16-17-11-13-19(14-12-17)18-8-4-2-5-9-18/h2,4-5,8-9,11-14,16H,3,6-7,10,15H2,1H3,(H,22,25)/b23-16-
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n/an/a 853n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221935
PNG
(CHEMBL326842)
Show SMILES CNC(=O)C(=O)C#CCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C21H21NO3/c1-22-21(24)20(23)11-7-2-3-8-16-25-19-14-12-18(13-15-19)17-9-5-4-6-10-17/h4-6,9-10,12-15H,2-3,8,16H2,1H3,(H,22,24)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221991
PNG
(CHEMBL322710)
Show SMILES CNC(=O)C(=O)CCCCCCC(=O)Nc1cccc(Oc2ccccc2)c1
Show InChI InChI=1S/C22H26N2O4/c1-23-22(27)20(25)14-7-2-3-8-15-21(26)24-17-10-9-13-19(16-17)28-18-11-5-4-6-12-18/h4-6,9-13,16H,2-3,7-8,14-15H2,1H3,(H,23,27)(H,24,26)
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n/an/a 1.04E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
HDACs


(Homo sapiens (human))
BDBM50221808
PNG
(CHEMBL325736)
Show SMILES CNC(=O)C(=O)COCCCCOc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H23NO4/c1-21-20(23)19(22)15-24-13-5-6-14-25-18-11-9-17(10-12-18)16-7-3-2-4-8-16/h2-4,7-12H,5-6,13-15H2,1H3,(H,21,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against mixture of histone deacetylase 1 (HDAC1) and histone deacetylase 2 (HDAC2) from nuclear extraction of K562 erythroleukemi...


Bioorg Med Chem Lett 13: 3331-5 (2003)


Article DOI: 10.1016/s0960-894x(03)00685-1
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%