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USPatent US8685992

Compile data set for download or QSAR
Found 120 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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US Patent
n/an/a 0.440n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 0.700n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 1.60n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 2n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119439
PNG
(BDBM119694 | US8685986, 13)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2cccs2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)25-21(18)23(29)24-13-14-3-5-16(6-4-14)22(28)26-30/h1-12,25,27,30H,13H2,(H,24,29)(H,26,28)
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n/an/a 6.60n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119690
PNG
(US8685992, 9)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C26H23N3O4/c1-33-21-12-10-18(11-13-21)22-16-23(19-7-3-2-4-8-19)28-25(22)26(31)27-20-9-5-6-17(14-20)15-24(30)29-32/h2-14,16,28,32H,15H2,1H3,(H,27,31)(H,29,30)
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US Patent
n/an/a 6.80n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119691
PNG
(US8685992, 10)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 10.8n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 35n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119438
PNG
(BDBM119693 | US8685986, 12)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(F)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C23H18FN3O4/c24-18-7-5-15(6-8-18)19-11-20(17-9-10-31-13-17)26-21(19)23(29)25-12-14-1-3-16(4-2-14)22(28)27-30/h1-11,13,26,30H,12H2,(H,25,29)(H,27,28)
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US Patent
n/an/a 42.8n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 46.1n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 49.9n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119692
PNG
(US8685992, 11)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2nc(cc2-c2ccc(F)cc2)-c2cccs2)nc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 52n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 59n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 60n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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US Patent
n/an/a 64.1n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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US Patent
n/an/a 71n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 72n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 74.8n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 75n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 84.2n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119706
PNG
(US8685992, 34)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C25H20N4O5/c30-24(28-32)19-8-6-16(7-9-19)15-26-25(31)23-21(17-10-12-20(13-11-17)29(33)34)14-22(27-23)18-4-2-1-3-5-18/h1-14,27,32H,15H2,(H,26,31)(H,28,30)
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n/an/a 86n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119705
PNG
(US8685992, 33)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 103n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119707
PNG
(US8685992, 35)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccccc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19Cl2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 108n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 124n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119438
PNG
(BDBM119693 | US8685986, 12)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(F)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C23H18FN3O4/c24-18-7-5-15(6-8-18)19-11-20(17-9-10-31-13-17)26-21(19)23(29)25-12-14-1-3-16(4-2-14)22(28)27-30/h1-11,13,26,30H,12H2,(H,25,29)(H,27,28)
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n/an/a 124n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 144n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 148n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 157n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 163n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 172n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 174n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 178n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119692
PNG
(US8685992, 11)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2nc(cc2-c2ccc(F)cc2)-c2cccs2)nc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 181n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 184n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 222n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119708
PNG
(US8685992, 36)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C25H20BrN3O3/c26-20-8-4-7-19(13-20)21-14-22(17-5-2-1-3-6-17)28-23(21)25(31)27-15-16-9-11-18(12-10-16)24(30)29-32/h1-14,28,32H,15H2,(H,27,31)(H,29,30)
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n/an/a 222n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119690
PNG
(US8685992, 9)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C26H23N3O4/c1-33-21-12-10-18(11-13-21)22-16-23(19-7-3-2-4-8-19)28-25(22)26(31)27-20-9-5-6-17(14-20)15-24(30)29-32/h2-14,16,28,32H,15H2,1H3,(H,27,31)(H,29,30)
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n/an/a 227n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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US Patent
n/an/a 273n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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US Patent
n/an/a 277n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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US Patent
n/an/a 290n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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US Patent
n/an/a 294n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119690
PNG
(US8685992, 9)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C26H23N3O4/c1-33-21-12-10-18(11-13-21)22-16-23(19-7-3-2-4-8-19)28-25(22)26(31)27-20-9-5-6-17(14-20)15-24(30)29-32/h2-14,16,28,32H,15H2,1H3,(H,27,31)(H,29,30)
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US Patent
n/an/a 298n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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US Patent
n/an/a 316n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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US Patent
n/an/a 318n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 319n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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US Patent
n/an/a 332n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM119440
PNG
(BDBM119696 | US8685986, 15)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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US Patent
n/an/a 338n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119691
PNG
(US8685992, 10)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 340n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 341n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119706
PNG
(US8685992, 34)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C25H20N4O5/c30-24(28-32)19-8-6-16(7-9-19)15-26-25(31)23-21(17-10-12-20(13-11-17)29(33)34)14-22(27-23)18-4-2-1-3-5-18/h1-14,27,32H,15H2,(H,26,31)(H,28,30)
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n/an/a 349n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119705
PNG
(US8685992, 33)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 364n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119690
PNG
(US8685992, 9)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C26H23N3O4/c1-33-21-12-10-18(11-13-21)22-16-23(19-7-3-2-4-8-19)28-25(22)26(31)27-20-9-5-6-17(14-20)15-24(30)29-32/h2-14,16,28,32H,15H2,1H3,(H,27,31)(H,29,30)
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n/an/a 378n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119438
PNG
(BDBM119693 | US8685986, 12)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(F)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C23H18FN3O4/c24-18-7-5-15(6-8-18)19-11-20(17-9-10-31-13-17)26-21(19)23(29)25-12-14-1-3-16(4-2-14)22(28)27-30/h1-11,13,26,30H,12H2,(H,25,29)(H,27,28)
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n/an/a 384n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119698
PNG
(US8685992, 21)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1N)-c1ccccc1
Show InChI InChI=1S/C25H19F2N3O3/c26-19-9-5-16(6-10-19)21-13-22(17-7-11-20(27)12-8-17)29-23(21)25(32)28-14-15-1-3-18(4-2-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 390n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 392n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119707
PNG
(US8685992, 35)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccccc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19Cl2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 433n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119438
PNG
(BDBM119693 | US8685986, 12)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(F)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C23H18FN3O4/c24-18-7-5-15(6-8-18)19-11-20(17-9-10-31-13-17)26-21(19)23(29)25-12-14-1-3-16(4-2-14)22(28)27-30/h1-11,13,26,30H,12H2,(H,25,29)(H,27,28)
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n/an/a 451n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119691
PNG
(US8685992, 10)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 473n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 478n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119691
PNG
(US8685992, 10)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 512n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119439
PNG
(BDBM119694 | US8685986, 13)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2cccs2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)25-21(18)23(29)24-13-14-3-5-16(6-4-14)22(28)26-30/h1-12,25,27,30H,13H2,(H,24,29)(H,26,28)
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n/an/a 559n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119439
PNG
(BDBM119694 | US8685986, 13)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2cccs2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)25-21(18)23(29)24-13-14-3-5-16(6-4-14)22(28)26-30/h1-12,25,27,30H,13H2,(H,24,29)(H,26,28)
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n/an/a 614n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 640n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 692n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 718n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 723n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119705
PNG
(US8685992, 33)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 732n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119692
PNG
(US8685992, 11)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2nc(cc2-c2ccc(F)cc2)-c2cccs2)nc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 745n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119708
PNG
(US8685992, 36)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C25H20BrN3O3/c26-20-8-4-7-19(13-20)21-14-22(17-5-2-1-3-6-17)28-23(21)25(31)27-15-16-9-11-18(12-10-16)24(30)29-32/h1-14,28,32H,15H2,(H,27,31)(H,29,30)
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n/an/a 752n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119692
PNG
(US8685992, 11)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2nc(cc2-c2ccc(F)cc2)-c2cccs2)nc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 754n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 762n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119706
PNG
(US8685992, 34)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C25H20N4O5/c30-24(28-32)19-8-6-16(7-9-19)15-26-25(31)23-21(17-10-12-20(13-11-17)29(33)34)14-22(27-23)18-4-2-1-3-5-18/h1-14,27,32H,15H2,(H,26,31)(H,28,30)
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n/an/a 770n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119707
PNG
(US8685992, 35)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccccc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19Cl2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 806n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119439
PNG
(BDBM119694 | US8685986, 13)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2cccs2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)25-21(18)23(29)24-13-14-3-5-16(6-4-14)22(28)26-30/h1-12,25,27,30H,13H2,(H,24,29)(H,26,28)
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n/an/a 865n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119690
PNG
(US8685992, 9)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C26H23N3O4/c1-33-21-12-10-18(11-13-21)22-16-23(19-7-3-2-4-8-19)28-25(22)26(31)27-20-9-5-6-17(14-20)15-24(30)29-32/h2-14,16,28,32H,15H2,1H3,(H,27,31)(H,29,30)
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n/an/a 909n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM119695
PNG
(US8685992, 14)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C28H27N3O3S/c1-34-23-13-11-20(12-14-23)24-17-25(21-5-3-2-4-6-21)31-26(24)28(33)30-18-19-7-9-22(10-8-19)27(32)29-15-16-35/h2-14,17,31,35H,15-16,18H2,1H3,(H,29,32)(H,30,33)
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n/an/a 956n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM119703
PNG
(US8685992, 27)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccoc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O3S/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 1.08E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119438
PNG
(BDBM119693 | US8685986, 12)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(F)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C23H18FN3O4/c24-18-7-5-15(6-8-18)19-11-20(17-9-10-31-13-17)26-21(19)23(29)25-12-14-1-3-16(4-2-14)22(28)27-30/h1-11,13,26,30H,12H2,(H,25,29)(H,27,28)
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n/an/a 1.15E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119706
PNG
(US8685992, 34)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C25H20N4O5/c30-24(28-32)19-8-6-16(7-9-19)15-26-25(31)23-21(17-10-12-20(13-11-17)29(33)34)14-22(27-23)18-4-2-1-3-5-18/h1-14,27,32H,15H2,(H,26,31)(H,28,30)
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n/an/a 1.26E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119698
PNG
(US8685992, 21)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1N)-c1ccccc1
Show InChI InChI=1S/C25H19F2N3O3/c26-19-9-5-16(6-10-19)21-13-22(17-7-11-20(27)12-8-17)29-23(21)25(32)28-14-15-1-3-18(4-2-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 1.27E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119691
PNG
(US8685992, 10)
Show SMILES ONC(=O)c1ccc(NC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 1.39E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 1.84E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119439
PNG
(BDBM119694 | US8685986, 13)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2cccs2)cc1
Show InChI InChI=1S/C23H19N3O4S/c27-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)25-21(18)23(29)24-13-14-3-5-16(6-4-14)22(28)26-30/h1-12,25,27,30H,13H2,(H,24,29)(H,26,28)
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n/an/a 1.91E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119708
PNG
(US8685992, 36)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C25H20BrN3O3/c26-20-8-4-7-19(13-20)21-14-22(17-5-2-1-3-6-17)28-23(21)25(31)27-15-16-9-11-18(12-10-16)24(30)29-32/h1-14,28,32H,15H2,(H,27,31)(H,29,30)
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n/an/a 2.07E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM119704
PNG
(US8685992, 28)
Show SMILES COc1ccc(cc1)-c1cc(-c2ccsc2)c([nH]1)C(=O)NCc1ccc(cc1)C(=O)NO
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(21-13-14-37-17-21)15-26(32-27)19-9-11-22(34)12-10-19/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a 2.43E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119692
PNG
(US8685992, 11)
Show SMILES ONC(=O)c1ccc(CNC(=O)c2nc(cc2-c2ccc(F)cc2)-c2cccs2)nc1
Show InChI InChI=1S/C23H19N3O5/c27-18-7-5-15(6-8-18)20-11-19(17-9-10-31-13-17)21(25-20)23(29)24-12-14-1-3-16(4-2-14)22(28)26-30/h1-11,13,25,27,30H,12H2,(H,24,29)(H,26,28)
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n/an/a 2.53E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 2.89E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119698
PNG
(US8685992, 21)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1N)-c1ccccc1
Show InChI InChI=1S/C25H19F2N3O3/c26-19-9-5-16(6-10-19)21-13-22(17-7-11-20(27)12-8-17)29-23(21)25(32)28-14-15-1-3-18(4-2-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a 3.90E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119701
PNG
(US8685992, 25)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccn1)-c1ccccc1
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119699
PNG
(US8685992, 22)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1S)-c1ccccc1
Show InChI InChI=1S/C23H18FN3O3S/c24-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)26-21(18)23(29)25-13-14-3-5-16(6-4-14)22(28)27-30/h1-12,26,30H,13H2,(H,25,29)(H,27,28)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119707
PNG
(US8685992, 35)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccccc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19Cl2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119708
PNG
(US8685992, 36)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C25H20BrN3O3/c26-20-8-4-7-19(13-20)21-14-22(17-5-2-1-3-6-17)28-23(21)25(31)27-15-16-9-11-18(12-10-16)24(30)29-32/h1-14,28,32H,15H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119699
PNG
(US8685992, 22)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1S)-c1ccccc1
Show InChI InChI=1S/C23H18FN3O3S/c24-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)26-21(18)23(29)25-13-14-3-5-16(6-4-14)22(28)27-30/h1-12,26,30H,13H2,(H,25,29)(H,27,28)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119701
PNG
(US8685992, 25)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccn1)-c1ccccc1
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119708
PNG
(US8685992, 36)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccsc2)cc1
Show InChI InChI=1S/C25H20BrN3O3/c26-20-8-4-7-19(13-20)21-14-22(17-5-2-1-3-6-17)28-23(21)25(31)27-15-16-9-11-18(12-10-16)24(30)29-32/h1-14,28,32H,15H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 7


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119699
PNG
(US8685992, 22)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1S)-c1ccccc1
Show InChI InChI=1S/C23H18FN3O3S/c24-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)26-21(18)23(29)25-13-14-3-5-16(6-4-14)22(28)27-30/h1-12,26,30H,13H2,(H,25,29)(H,27,28)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119702
PNG
(US8685992, 26)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ncccn1)-c1ccccc1
Show InChI InChI=1S/C31H26N4O3/c32-26-8-4-5-9-27(26)35-30(37)23-12-10-20(11-13-23)19-33-31(38)29-25(21-6-2-1-3-7-21)18-28(34-29)22-14-16-24(36)17-15-22/h1-18,34,36H,19,32H2,(H,33,38)(H,35,37)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119698
PNG
(US8685992, 21)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1N)-c1ccccc1
Show InChI InChI=1S/C25H19F2N3O3/c26-19-9-5-16(6-10-19)21-13-22(17-7-11-20(27)12-8-17)29-23(21)25(32)28-14-15-1-3-18(4-2-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119705
PNG
(US8685992, 33)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119698
PNG
(US8685992, 21)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1N)-c1ccccc1
Show InChI InChI=1S/C25H19F2N3O3/c26-19-9-5-16(6-10-19)21-13-22(17-7-11-20(27)12-8-17)29-23(21)25(32)28-14-15-1-3-18(4-2-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119705
PNG
(US8685992, 33)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccsc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19F2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119701
PNG
(US8685992, 25)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccn1)-c1ccccc1
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119701
PNG
(US8685992, 25)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccn1)-c1ccccc1
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119707
PNG
(US8685992, 35)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccccc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C25H19Cl2N3O3/c26-20-11-10-18(12-21(20)27)19-13-22(16-4-2-1-3-5-16)29-23(19)25(32)28-14-15-6-8-17(9-7-15)24(31)30-33/h1-13,29,33H,14H2,(H,28,32)(H,30,31)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 9


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119699
PNG
(US8685992, 22)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1S)-c1ccccc1
Show InChI InChI=1S/C23H18FN3O3S/c24-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)26-21(18)23(29)25-13-14-3-5-16(6-4-14)22(28)27-30/h1-12,26,30H,13H2,(H,25,29)(H,27,28)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119702
PNG
(US8685992, 26)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ncccn1)-c1ccccc1
Show InChI InChI=1S/C31H26N4O3/c32-26-8-4-5-9-27(26)35-30(37)23-12-10-20(11-13-23)19-33-31(38)29-25(21-6-2-1-3-7-21)18-28(34-29)22-14-16-24(36)17-15-22/h1-18,34,36H,19,32H2,(H,33,38)(H,35,37)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 4


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 1


(Homo sapiens (Human))
BDBM119701
PNG
(US8685992, 25)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccn1)-c1ccccc1
Show InChI InChI=1S/C29H24N4O4/c30-24-3-1-2-4-25(24)33-28(35)20-7-5-18(6-8-20)16-31-29(36)27-23(19-9-11-22(34)12-10-19)15-26(32-27)21-13-14-37-17-21/h1-15,17,32,34H,16,30H2,(H,31,36)(H,33,35)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM119702
PNG
(US8685992, 26)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ncccn1)-c1ccccc1
Show InChI InChI=1S/C31H26N4O3/c32-26-8-4-5-9-27(26)35-30(37)23-12-10-20(11-13-23)19-33-31(38)29-25(21-6-2-1-3-7-21)18-28(34-29)22-14-16-24(36)17-15-22/h1-18,34,36H,19,32H2,(H,33,38)(H,35,37)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119699
PNG
(US8685992, 22)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ccccc1S)-c1ccccc1
Show InChI InChI=1S/C23H18FN3O3S/c24-17-9-7-15(8-10-17)18-12-19(20-2-1-11-31-20)26-21(18)23(29)25-13-14-3-5-16(6-4-14)22(28)27-30/h1-12,26,30H,13H2,(H,25,29)(H,27,28)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119706
PNG
(US8685992, 34)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccc(O)cc2)-c2ccoc2)cc1
Show InChI InChI=1S/C25H20N4O5/c30-24(28-32)19-8-6-16(7-9-19)15-26-25(31)23-21(17-10-12-20(13-11-17)29(33)34)14-22(27-23)18-4-2-1-3-5-18/h1-14,27,32H,15H2,(H,26,31)(H,28,30)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM119702
PNG
(US8685992, 26)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ncccn1)-c1ccccc1
Show InChI InChI=1S/C31H26N4O3/c32-26-8-4-5-9-27(26)35-30(37)23-12-10-20(11-13-23)19-33-31(38)29-25(21-6-2-1-3-7-21)18-28(34-29)22-14-16-24(36)17-15-22/h1-18,34,36H,19,32H2,(H,33,38)(H,35,37)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM119702
PNG
(US8685992, 26)
Show SMILES COc1ccc(cc1)-c1cc([nH]c1C(=O)NCc1ccc(cc1)C(=O)Nc1ncccn1)-c1ccccc1
Show InChI InChI=1S/C31H26N4O3/c32-26-8-4-5-9-27(26)35-30(37)23-12-10-20(11-13-23)19-33-31(38)29-25(21-6-2-1-3-7-21)18-28(34-29)22-14-16-24(36)17-15-22/h1-18,34,36H,19,32H2,(H,33,38)(H,35,37)
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n/an/a>5.00E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 5.66E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 5.83E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Polyamine deacetylase HDAC10


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 8.55E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
Histone deacetylase 5


(Homo sapiens (Human))
BDBM119709
PNG
(US8685992, 37)
Show SMILES Nc1ccccc1NC(=O)c1ccc(CNC(=O)c2[nH]c(cc2-c2ccoc2)-c2ccc(O)cc2)cc1
Show InChI InChI=1S/C24H19FN4O3/c25-19-9-7-16(8-10-19)20-12-21(18-2-1-11-26-14-18)28-22(20)24(31)27-13-15-3-5-17(6-4-15)23(30)29-32/h1-12,14,28,32H,13H2,(H,27,31)(H,29,30)
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n/an/a 8.64E+3n/an/an/an/an/a30



Universidad del País Vasco; Ikerschem, S.L.

US Patent


Assay Description
The reactions were carried out in a 96-well microplate for fluorometry in a 50 μl reaction volume. After the deacetylation reaction, Fluor-de-Ly...


US Patent US8685992 (2014)


BindingDB Entry DOI: 10.7270/Q2CJ8C4X
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%