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Compile Data Set for Download or QSAR

Found 59 hits Enz. Inhib. hit(s) with all data for entry = 50014247   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase HD2


(Zea mays)
BDBM19130
PNG
((2E,4E,6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4...)
Show SMILES CC(C=CC(=O)NO)C=C(C)C(=O)c1ccc(cc1)N(C)C
Show InChI InChI=1S/C17H22N2O3/c1-12(5-10-16(20)18-22)11-13(2)17(21)14-6-8-15(9-7-14)19(3)4/h5-12,22H,1-4H3,(H,18,20)
KEGG

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n/an/a 7.20n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50134805
PNG
(6,9-Dibenzyl-12-(6-oxiranyl-6-oxo-hexyl)-decahydro...)
Show SMILES O=C(CCCCC[C@@H]1NC(=O)[C@H]2CCCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC1=O)C1CO1
Show InChI InChI=1S/C34H42N4O6/c39-29(30-22-44-30)18-9-3-8-16-25-31(40)36-26(20-23-12-4-1-5-13-23)32(41)37-27(21-24-14-6-2-7-15-24)34(43)38-19-11-10-17-28(38)33(42)35-25/h1-2,4-7,12-15,25-28,30H,3,8-11,16-22H2,(H,35,42)(H,36,40)(H,37,41)/t25-,26-,27-,28+,30?/m0/s1
KEGG

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n/an/a 10n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139952
PNG
(CHEMBL268286 | N-Hydroxy-3-[1-methyl-4-(3-phenyl-p...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCc1ccccc1
Show InChI InChI=1S/C17H18N2O3/c1-19-12-14(11-15(19)8-10-17(21)18-22)16(20)9-7-13-5-3-2-4-6-13/h2-6,8,10-12,22H,7,9H2,1H3,(H,18,21)
KEGG

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n/an/a 43n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139952
PNG
(CHEMBL268286 | N-Hydroxy-3-[1-methyl-4-(3-phenyl-p...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCc1ccccc1
Show InChI InChI=1S/C17H18N2O3/c1-19-12-14(11-15(19)8-10-17(21)18-22)16(20)9-7-13-5-3-2-4-6-13/h2-6,8,10-12,22H,7,9H2,1H3,(H,18,21)
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n/an/a 43n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
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 50n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139949
PNG
(CHEMBL13200 | N-Hydroxy-3-[1-methyl-4-(6-phenyl-he...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCc1ccccc1
Show InChI InChI=1S/C20H24N2O3/c1-22-15-17(14-18(22)12-13-20(24)21-25)19(23)11-7-3-6-10-16-8-4-2-5-9-16/h2,4-5,8-9,12-15,25H,3,6-7,10-11H2,1H3,(H,21,24)
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n/an/a 71n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139949
PNG
(CHEMBL13200 | N-Hydroxy-3-[1-methyl-4-(6-phenyl-he...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCc1ccccc1
Show InChI InChI=1S/C20H24N2O3/c1-22-15-17(14-18(22)12-13-20(24)21-25)19(23)11-7-3-6-10-16-8-4-2-5-9-16/h2,4-5,8-9,12-15,25H,3,6-7,10-11H2,1H3,(H,21,24)
KEGG

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n/an/a 71n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50135752
PNG
((2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-1H-pyr...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C16H16N2O3/c1-18-11-13(10-14(18)7-8-16(20)17-21)15(19)9-12-5-3-2-4-6-12/h2-8,10-11,21H,9H2,1H3,(H,17,20)
KEGG

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n/an/a 100n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139935
PNG
(CHEMBL12927 | N-Hydroxy-3-[1-methyl-4-(1-phenyl-cy...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)C1(CC1)c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-20-12-13(11-15(20)7-8-16(21)19-23)17(22)18(9-10-18)14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3,(H,19,21)/b8-7+
KEGG

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n/an/a 100n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50135752
PNG
((2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-1H-pyr...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C16H16N2O3/c1-18-11-13(10-14(18)7-8-16(20)17-21)15(19)9-12-5-3-2-4-6-12/h2-8,10-11,21H,9H2,1H3,(H,17,20)
KEGG

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n/an/a 100n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139935
PNG
(CHEMBL12927 | N-Hydroxy-3-[1-methyl-4-(1-phenyl-cy...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)C1(CC1)c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-20-12-13(11-15(20)7-8-16(21)19-23)17(22)18(9-10-18)14-5-3-2-4-6-14/h2-8,11-12,23H,9-10H2,1H3,(H,19,21)/b8-7+
KEGG

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n/an/a 101n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139937
PNG
(CHEMBL274906 | N-Hydroxy-3-[1-methyl-4-(5-phenyl-p...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCc1ccccc1
Show InChI InChI=1S/C19H22N2O3/c1-21-14-16(13-17(21)11-12-19(23)20-24)18(22)10-6-5-9-15-7-3-2-4-8-15/h2-4,7-8,11-14,24H,5-6,9-10H2,1H3,(H,20,23)
KEGG

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n/an/a 110n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139937
PNG
(CHEMBL274906 | N-Hydroxy-3-[1-methyl-4-(5-phenyl-p...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCc1ccccc1
Show InChI InChI=1S/C19H22N2O3/c1-21-14-16(13-17(21)11-12-19(23)20-24)18(22)10-6-5-9-15-7-3-2-4-8-15/h2-4,7-8,11-14,24H,5-6,9-10H2,1H3,(H,20,23)
KEGG

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n/an/a 110n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139942
PNG
((5S,8S,11S)-5,8-Dimethyl-11-(6-oxiranyl-6-oxo-hexy...)
Show SMILES C[C@@H]1NC(=O)[C@H](C)NC(=O)[C@H](CCCCCC(=O)C2CO2)NC(=O)CCCCCNC1=O
Show InChI InChI=1S/C22H36N4O6/c1-14-20(29)23-12-8-4-7-11-19(28)26-16(22(31)25-15(2)21(30)24-14)9-5-3-6-10-17(27)18-13-32-18/h14-16,18H,3-13H2,1-2H3,(H,23,29)(H,24,30)(H,25,31)(H,26,28)/t14-,15-,16-,18?/m0/s1
KEGG

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n/an/a 110n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139945
PNG
(CHEMBL273731 | N-Hydroxy-3-[1-methyl-4-(naphthalen...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C19H16N2O3/c1-21-12-16(11-17(21)8-9-18(22)20-24)19(23)15-7-6-13-4-2-3-5-14(13)10-15/h2-12,24H,1H3,(H,20,22)/b9-8+
KEGG

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n/an/a 115n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139945
PNG
(CHEMBL273731 | N-Hydroxy-3-[1-methyl-4-(naphthalen...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1ccc2ccccc2c1
Show InChI InChI=1S/C19H16N2O3/c1-21-12-16(11-17(21)8-9-18(22)20-24)19(23)15-7-6-13-4-2-3-5-14(13)10-15/h2-12,24H,1H3,(H,20,22)/b9-8+
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n/an/a 115n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139947
PNG
(CHEMBL265077 | N-Hydroxy-3-[1-methyl-4-(4-phenyl-b...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCc1ccccc1
Show InChI InChI=1S/C18H20N2O3/c1-20-13-15(12-16(20)10-11-18(22)19-23)17(21)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-13,23H,5,8-9H2,1H3,(H,19,22)
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n/an/a 129n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139947
PNG
(CHEMBL265077 | N-Hydroxy-3-[1-methyl-4-(4-phenyl-b...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCc1ccccc1
Show InChI InChI=1S/C18H20N2O3/c1-20-13-15(12-16(20)10-11-18(22)19-23)17(21)9-5-8-14-6-3-2-4-7-14/h2-4,6-7,10-13,23H,5,8-9H2,1H3,(H,19,22)
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n/an/a 130n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139944
PNG
(CHEMBL12890 | N-Hydroxy-3-[1-methyl-4-(naphthalene...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C19H16N2O3/c1-21-12-14(11-15(21)9-10-18(22)20-24)19(23)17-8-4-6-13-5-2-3-7-16(13)17/h2-12,24H,1H3,(H,20,22)/b10-9+
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n/an/a 144n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139944
PNG
(CHEMBL12890 | N-Hydroxy-3-[1-methyl-4-(naphthalene...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1cccc2ccccc12
Show InChI InChI=1S/C19H16N2O3/c1-21-12-14(11-15(21)9-10-18(22)20-24)19(23)17-8-4-6-13-5-2-3-7-16(13)17/h2-12,24H,1H3,(H,20,22)/b10-9+
KEGG

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n/an/a 145n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139930
PNG
(CHEMBL269230 | N,N'-Dihydroxy-2-(1-methyl-4-phenyl...)
Show SMILES Cn1cc(cc1C=C(C(=O)NO)C(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C17H17N3O5/c1-20-10-12(15(21)7-11-5-3-2-4-6-11)8-13(20)9-14(16(22)18-24)17(23)19-25/h2-6,8-10,24-25H,7H2,1H3,(H,18,22)(H,19,23)
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n/an/a 200n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139930
PNG
(CHEMBL269230 | N,N'-Dihydroxy-2-(1-methyl-4-phenyl...)
Show SMILES Cn1cc(cc1C=C(C(=O)NO)C(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C17H17N3O5/c1-20-10-12(15(21)7-11-5-3-2-4-6-11)8-13(20)9-14(16(22)18-24)17(23)19-25/h2-6,8-10,24-25H,7H2,1H3,(H,18,22)(H,19,23)
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n/an/a 200n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139951
PNG
(CHEMBL273454 | N-Hydroxy-3-[1-methyl-4-(8-phenyl-o...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCCCc1ccccc1
Show InChI InChI=1S/C22H28N2O3/c1-24-17-19(16-20(24)14-15-22(26)23-27)21(25)13-9-4-2-3-6-10-18-11-7-5-8-12-18/h5,7-8,11-12,14-17,27H,2-4,6,9-10,13H2,1H3,(H,23,26)
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n/an/a 209n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139951
PNG
(CHEMBL273454 | N-Hydroxy-3-[1-methyl-4-(8-phenyl-o...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCCCc1ccccc1
Show InChI InChI=1S/C22H28N2O3/c1-24-17-19(16-20(24)14-15-22(26)23-27)21(25)13-9-4-2-3-6-10-18-11-7-5-8-12-18/h5,7-8,11-12,14-17,27H,2-4,6,9-10,13H2,1H3,(H,23,26)
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n/an/a 209n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139953
PNG
(CHEMBL13152 | N-Hydroxy-3-[1-methyl-4-(7-phenyl-he...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCCc1ccccc1
Show InChI InChI=1S/C21H26N2O3/c1-23-16-18(15-19(23)13-14-21(25)22-26)20(24)12-8-3-2-5-9-17-10-6-4-7-11-17/h4,6-7,10-11,13-16,26H,2-3,5,8-9,12H2,1H3,(H,22,25)
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n/an/a 263n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139953
PNG
(CHEMBL13152 | N-Hydroxy-3-[1-methyl-4-(7-phenyl-he...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)CCCCCCc1ccccc1
Show InChI InChI=1S/C21H26N2O3/c1-23-16-18(15-19(23)13-14-21(25)22-26)20(24)12-8-3-2-5-9-17-10-6-4-7-11-17/h4,6-7,10-11,13-16,26H,2-3,5,8-9,12H2,1H3,(H,22,25)
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n/an/a 266n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139939
PNG
(CHEMBL276707 | N-Hydroxy-3-[1-methyl-4-(2-phenyl-c...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)C1CC1c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-20-11-13(9-14(20)7-8-17(21)19-23)18(22)16-10-15(16)12-5-3-2-4-6-12/h2-9,11,15-16,23H,10H2,1H3,(H,19,21)
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n/an/a 309n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139939
PNG
(CHEMBL276707 | N-Hydroxy-3-[1-methyl-4-(2-phenyl-c...)
Show SMILES Cn1cc(cc1C=CC(=O)NO)C(=O)C1CC1c1ccccc1
Show InChI InChI=1S/C18H18N2O3/c1-20-11-13(9-14(20)7-8-17(21)19-23)18(22)16-10-15(16)12-5-3-2-4-6-12/h2-9,11,15-16,23H,10H2,1H3,(H,19,21)
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n/an/a 310n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139933
PNG
(5-(4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-penta-2,4-di...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O3/c1-19-12-14(17(21)13-7-3-2-4-8-13)11-15(19)9-5-6-10-16(20)18-22/h2-12,22H,1H3,(H,18,20)/b9-5+,10-6+
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n/an/a 770n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139933
PNG
(5-(4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-penta-2,4-di...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)c1ccccc1
Show InChI InChI=1S/C17H16N2O3/c1-19-12-14(17(21)13-7-3-2-4-8-13)11-15(19)9-5-6-10-16(20)18-22/h2-12,22H,1H3,(H,18,20)/b9-5+,10-6+
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n/an/a 776n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50135756
PNG
(CHEMBL411020 | N-Hydroxy-3-[(E)-1-methyl-4-(3-phen...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C17H16N2O3/c1-19-12-14(11-15(19)8-10-17(21)18-22)16(20)9-7-13-5-3-2-4-6-13/h2-12,22H,1H3,(H,18,21)/b9-7+,10-8+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50135756
PNG
(CHEMBL411020 | N-Hydroxy-3-[(E)-1-methyl-4-(3-phen...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C17H16N2O3/c1-19-12-14(11-15(19)8-10-17(21)18-22)16(20)9-7-13-5-3-2-4-6-13/h2-12,22H,1H3,(H,18,21)/b9-7+,10-8+
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n/an/a 1.00E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139936
PNG
(CHEMBL275089 | N-Hydroxy-3-(1-methyl-4-phenylacety...)
Show SMILES Cn1cc(cc1CCC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C16H18N2O3/c1-18-11-13(10-14(18)7-8-16(20)17-21)15(19)9-12-5-3-2-4-6-12/h2-6,10-11,21H,7-9H2,1H3,(H,17,20)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139936
PNG
(CHEMBL275089 | N-Hydroxy-3-(1-methyl-4-phenylacety...)
Show SMILES Cn1cc(cc1CCC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C16H18N2O3/c1-18-11-13(10-14(18)7-8-16(20)17-21)15(19)9-12-5-3-2-4-6-12/h2-6,10-11,21H,7-9H2,1H3,(H,17,20)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139931
PNG
((E)-N-Hydroxy-2-methyl-3-{1-methyl-4-[(E)-(3-pheny...)
Show SMILES C\C(=C/c1cc(cn1C)C(=O)\C=C\c1ccccc1)C(=O)NO
Show InChI InChI=1S/C18H18N2O3/c1-13(18(22)19-23)10-16-11-15(12-20(16)2)17(21)9-8-14-6-4-3-5-7-14/h3-12,23H,1-2H3,(H,19,22)/b9-8+,13-10+
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n/an/a 1.29E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139931
PNG
((E)-N-Hydroxy-2-methyl-3-{1-methyl-4-[(E)-(3-pheny...)
Show SMILES C\C(=C/c1cc(cn1C)C(=O)\C=C\c1ccccc1)C(=O)NO
Show InChI InChI=1S/C18H18N2O3/c1-13(18(22)19-23)10-16-11-15(12-20(16)2)17(21)9-8-14-6-4-3-5-7-14/h3-12,23H,1-2H3,(H,19,22)/b9-8+,13-10+
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n/an/a 1.30E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139932
PNG
(CHEMBL13000 | N-Hydroxy-2-methyl-3-(1-methyl-4-phe...)
Show SMILES CC(=Cc1cc(cn1C)C(=O)Cc1ccccc1)C(=O)NO
Show InChI InChI=1S/C17H18N2O3/c1-12(17(21)18-22)8-15-10-14(11-19(15)2)16(20)9-13-6-4-3-5-7-13/h3-8,10-11,22H,9H2,1-2H3,(H,18,21)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139932
PNG
(CHEMBL13000 | N-Hydroxy-2-methyl-3-(1-methyl-4-phe...)
Show SMILES CC(=Cc1cc(cn1C)C(=O)Cc1ccccc1)C(=O)NO
Show InChI InChI=1S/C17H18N2O3/c1-12(17(21)18-22)8-15-10-14(11-19(15)2)16(20)9-13-6-4-3-5-7-13/h3-8,10-11,22H,9H2,1-2H3,(H,18,21)
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n/an/a 1.41E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139941
PNG
(1-[5-((1E,3E)-4-Hydroxyamino-buta-1,3-dienyl)-1-me...)
Show SMILES Cn1cc(cc1C=CCCN=O)C(=O)Cc1ccccc1
Show InChI InChI=1S/C17H18N2O2/c1-19-13-15(12-16(19)9-5-6-10-18-21)17(20)11-14-7-3-2-4-8-14/h2-5,7-9,12-13H,6,10-11H2,1H3
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n/an/a 1.48E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139941
PNG
(1-[5-((1E,3E)-4-Hydroxyamino-buta-1,3-dienyl)-1-me...)
Show SMILES Cn1cc(cc1C=CCCN=O)C(=O)Cc1ccccc1
Show InChI InChI=1S/C17H18N2O2/c1-19-13-15(12-16(19)9-5-6-10-18-21)17(20)11-14-7-3-2-4-8-14/h2-5,7-9,12-13H,6,10-11H2,1H3
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n/an/a 1.48E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139940
PNG
(3-(4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-N-hydroxy-2-...)
Show SMILES C\C(=C/c1cc(cn1C)C(=O)c1ccccc1)C(=O)NO
Show InChI InChI=1S/C16H16N2O3/c1-11(16(20)17-21)8-14-9-13(10-18(14)2)15(19)12-6-4-3-5-7-12/h3-10,21H,1-2H3,(H,17,20)/b11-8+
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n/an/a 2.69E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139940
PNG
(3-(4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-N-hydroxy-2-...)
Show SMILES C\C(=C/c1cc(cn1C)C(=O)c1ccccc1)C(=O)NO
Show InChI InChI=1S/C16H16N2O3/c1-11(16(20)17-21)8-14-9-13(10-18(14)2)15(19)12-6-4-3-5-7-12/h3-10,21H,1-2H3,(H,17,20)/b11-8+
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n/an/a 2.70E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50100452
PNG
(3-((E)-4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-N-hydrox...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1ccccc1
Show InChI InChI=1S/C15H14N2O3/c1-17-10-12(9-13(17)7-8-14(18)16-20)15(19)11-5-3-2-4-6-11/h2-10,20H,1H3,(H,16,18)/b8-7+
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n/an/a 3.80E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50100452
PNG
(3-((E)-4-Benzoyl-1-methyl-1H-pyrrol-2-yl)-N-hydrox...)
Show SMILES Cn1cc(cc1\C=C\C(=O)NO)C(=O)c1ccccc1
Show InChI InChI=1S/C15H14N2O3/c1-17-10-12(9-13(17)7-8-14(18)16-20)15(19)11-5-3-2-4-6-11/h2-10,20H,1H3,(H,16,18)/b8-7+
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n/an/a 3.80E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139948
PNG
((E)-5-[1-Methyl-4-(3-phenyl-acryloyl)-1H-pyrrol-2-...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C19H18N2O3/c1-21-14-16(13-17(21)9-5-6-10-19(23)20-24)18(22)12-11-15-7-3-2-4-8-15/h2-14,24H,1H3,(H,20,23)/b9-5+,10-6+,12-11+
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n/an/a 9.90E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139948
PNG
((E)-5-[1-Methyl-4-(3-phenyl-acryloyl)-1H-pyrrol-2-...)
Show SMILES Cn1cc(cc1\C=C\C=C\C(=O)NO)C(=O)\C=C\c1ccccc1
Show InChI InChI=1S/C19H18N2O3/c1-21-14-16(13-17(21)9-5-6-10-19(23)20-24)18(22)12-11-15-7-3-2-4-8-15/h2-14,24H,1H3,(H,20,23)/b9-5+,10-6+,12-11+
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n/an/a 1.00E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139946
PNG
(CHEMBL267309 | N-Hydroxy-2-(1-methyl-4-phenylacety...)
Show SMILES Cn1cc(cc1CC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H16N2O3/c1-17-10-12(8-13(17)9-15(19)16-20)14(18)7-11-5-3-2-4-6-11/h2-6,8,10,20H,7,9H2,1H3,(H,16,19)
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n/an/a 1.07E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibitory concentration against histone deacetylase HD2 enzyme.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139946
PNG
(CHEMBL267309 | N-Hydroxy-2-(1-methyl-4-phenylacety...)
Show SMILES Cn1cc(cc1CC(=O)NO)C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H16N2O3/c1-17-10-12(8-13(17)9-15(19)16-20)14(18)7-11-5-3-2-4-6-11/h2-6,8,10,20H,7,9H2,1H3,(H,16,19)
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n/an/a 1.08E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139950
PNG
(CHEMBL422390 | N-Hydroxy-2-(1-methyl-5-phenylacety...)
Show SMILES Cn1c(CC(=O)NO)ccc1C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H16N2O3/c1-17-12(10-15(19)16-20)7-8-13(17)14(18)9-11-5-3-2-4-6-11/h2-8,20H,9-10H2,1H3,(H,16,19)
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n/an/a 1.70E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
Histone deacetylase HD2


(Zea mays)
BDBM50139950
PNG
(CHEMBL422390 | N-Hydroxy-2-(1-methyl-5-phenylacety...)
Show SMILES Cn1c(CC(=O)NO)ccc1C(=O)Cc1ccccc1
Show InChI InChI=1S/C15H16N2O3/c1-17-12(10-15(19)16-20)7-8-13(17)14(18)9-11-5-3-2-4-6-11/h2-8,20H,9-10H2,1H3,(H,16,19)
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n/an/a 1.71E+4n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Concentration required for inhibition of histone deacetylase HD2 in vitro.


J Med Chem 47: 1098-109 (2004)

Checked by Author
Article DOI: 10.1021/jm030990+
BindingDB Entry DOI: 10.7270/Q24X5773
More data for this
Ligand-Target Pair
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