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Compile Data Set for Download or QSAR

Found 82 hits with Last Name = 'garcha' and Initial = 'hk'   
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))
BDBM50603512
PNG
(CHEMBL5177475)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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4.10n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50595960
PNG
(CHEMBL5192865)
Show SMILES ONC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
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17n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM110036
PNG
(US8609678, 2-((2-chlorophenyl)(phenyl)amino)-N-(7-...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1Cl
Show InChI InChI=1S/C24H26ClN5O3/c25-20-12-7-8-13-21(20)30(19-10-4-3-5-11-19)24-27-16-18(17-28-24)23(32)26-15-9-2-1-6-14-22(31)29-33/h3-5,7-8,10-13,16-17,33H,1-2,6,9,14-15H2,(H,26,32)(H,29,31)
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n/an/a 2.20n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50439674
PNG
(RICOLINOSTAT | US10858323, Compound 2 | US11207431...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C24H27N5O3/c30-22(28-32)15-9-1-2-10-16-25-23(31)19-17-26-24(27-18-19)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-14,17-18,32H,1-2,9-10,15-16H2,(H,25,31)(H,28,30)
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n/an/a 2.60n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50595950
PNG
(CHEMBL5179295)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F
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n/an/a 4.30n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM19149
PNG
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
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n/an/a 5.80n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603512
PNG
(CHEMBL5177475)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 6n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM19149
PNG
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
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n/an/a 6.60n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50595960
PNG
(CHEMBL5192865)
Show SMILES ONC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
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n/an/a 8.5n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50398716
PNG
(CHEMBL2179618 | US10227295, Compound 5g | US940985...)
Show SMILES CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H23N3O3/c1-2-3-13-22(19(24)20-17-7-5-4-6-8-17)14-15-9-11-16(12-10-15)18(23)21-25/h4-12,25H,2-3,13-14H2,1H3,(H,20,24)(H,21,23)
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n/an/a 12n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM110036
PNG
(US8609678, 2-((2-chlorophenyl)(phenyl)amino)-N-(7-...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1Cl
Show InChI InChI=1S/C24H26ClN5O3/c25-20-12-7-8-13-21(20)30(19-10-4-3-5-11-19)24-27-16-18(17-28-24)23(32)26-15-9-2-1-6-14-22(31)29-33/h3-5,7-8,10-13,16-17,33H,1-2,6,9,14-15H2,(H,26,32)(H,29,31)
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n/an/a 13n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50439674
PNG
(RICOLINOSTAT | US10858323, Compound 2 | US11207431...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C24H27N5O3/c30-22(28-32)15-9-1-2-10-16-25-23(31)19-17-26-24(27-18-19)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-14,17-18,32H,1-2,9-10,15-16H2,(H,25,31)(H,28,30)
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n/an/a 14n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50555683
PNG
(CHEMBL4763401)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)C(=O)c1c(F)c(F)c(F)c(F)c1F
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n/an/a 14n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603511
PNG
(CHEMBL5173782)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)Cc1cc(F)c(F)c(F)c1F
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n/an/a 16n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603516
PNG
(CHEMBL5202595)
Show SMILES CC(C)CN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 25n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603517
PNG
(CHEMBL5191960)
Show SMILES COCCN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 28n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603514
PNG
(CHEMBL5199669)
Show SMILES ONC(=O)c1ccc(CN(C2CCCC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
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n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603519
PNG
(CHEMBL5202970)
Show SMILES ONC(=O)c1ccc2CN(CCc2c1)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 50n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603513
PNG
(CHEMBL5184540)
Show SMILES CC(C)N(Cc1ccc(CC(=O)NO)cc1)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 85n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603515
PNG
(CHEMBL5195141)
Show SMILES CC(C)N(Cc1ccc(cn1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 121n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603513
PNG
(CHEMBL5184540)
Show SMILES CC(C)N(Cc1ccc(CC(=O)NO)cc1)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 143n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM110036
PNG
(US8609678, 2-((2-chlorophenyl)(phenyl)amino)-N-(7-...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1Cl
Show InChI InChI=1S/C24H26ClN5O3/c25-20-12-7-8-13-21(20)30(19-10-4-3-5-11-19)24-27-16-18(17-28-24)23(32)26-15-9-2-1-6-14-22(31)29-33/h3-5,7-8,10-13,16-17,33H,1-2,6,9,14-15H2,(H,26,32)(H,29,31)
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n/an/a 171n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50398716
PNG
(CHEMBL2179618 | US10227295, Compound 5g | US940985...)
Show SMILES CCCCN(Cc1ccc(cc1)C(=O)NO)C(=O)Nc1ccccc1
Show InChI InChI=1S/C19H23N3O3/c1-2-3-13-22(19(24)20-17-7-5-4-6-8-17)14-15-9-11-16(12-10-15)18(23)21-25/h4-12,25H,2-3,13-14H2,1H3,(H,20,24)(H,21,23)
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n/an/a 238n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50439674
PNG
(RICOLINOSTAT | US10858323, Compound 2 | US11207431...)
Show SMILES ONC(=O)CCCCCCNC(=O)c1cnc(nc1)N(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C24H27N5O3/c30-22(28-32)15-9-1-2-10-16-25-23(31)19-17-26-24(27-18-19)29(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-8,11-14,17-18,32H,1-2,9-10,15-16H2,(H,25,31)(H,28,30)
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n/an/a 245n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 2


(Homo sapiens (Human))
BDBM50603512
PNG
(CHEMBL5177475)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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n/an/a 316n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603518
PNG
(CHEMBL5208971)
Show SMILES COc1cc(ccc1CN(C(C)C)S(=O)(=O)c1cc(F)c(F)c(F)c1F)C(=O)NO
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n/an/a 474n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM19149
PNG
(CHEMBL98 | N-hydroxy-N'-phenyloctanediamide | SAHA...)
Show SMILES ONC(=O)CCCCCCC(=O)Nc1ccccc1
Show InChI InChI=1S/C14H20N2O3/c17-13(15-12-8-4-3-5-9-12)10-6-1-2-7-11-14(18)16-19/h3-5,8-9,19H,1-2,6-7,10-11H2,(H,15,17)(H,16,18)
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n/an/a 497n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50595950
PNG
(CHEMBL5179295)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50555683
PNG
(CHEMBL4763401)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)C(=O)c1c(F)c(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603511
PNG
(CHEMBL5173782)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)Cc1cc(F)c(F)c(F)c1F
PDB

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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50595950
PNG
(CHEMBL5179295)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 11


(Homo sapiens (Human))
BDBM50595950
PNG
(CHEMBL5179295)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1c(F)c(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50595960
PNG
(CHEMBL5192865)
Show SMILES ONC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603512
PNG
(CHEMBL5177475)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603513
PNG
(CHEMBL5184540)
Show SMILES CC(C)N(Cc1ccc(CC(=O)NO)cc1)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603514
PNG
(CHEMBL5199669)
Show SMILES ONC(=O)c1ccc(CN(C2CCCC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
PDB

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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603515
PNG
(CHEMBL5195141)
Show SMILES CC(C)N(Cc1ccc(cn1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603516
PNG
(CHEMBL5202595)
Show SMILES CC(C)CN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603517
PNG
(CHEMBL5191960)
Show SMILES COCCN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603518
PNG
(CHEMBL5208971)
Show SMILES COc1cc(ccc1CN(C(C)C)S(=O)(=O)c1cc(F)c(F)c(F)c1F)C(=O)NO
PDB

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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50603519
PNG
(CHEMBL5202970)
Show SMILES ONC(=O)c1ccc2CN(CCc2c1)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 3


(Homo sapiens (Human))
BDBM50555683
PNG
(CHEMBL4763401)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)C(=O)c1c(F)c(F)c(F)c(F)c1F
PDB

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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 6


(Homo sapiens (Human))
BDBM50603518
PNG
(CHEMBL5208971)
Show SMILES COc1cc(ccc1CN(C(C)C)S(=O)(=O)c1cc(F)c(F)c(F)c1F)C(=O)NO
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50595960
PNG
(CHEMBL5192865)
Show SMILES ONC(=O)c1ccc(CN(C2CC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603512
PNG
(CHEMBL5177475)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603514
PNG
(CHEMBL5199669)
Show SMILES ONC(=O)c1ccc(CN(C2CCCC2)S(=O)(=O)c2cc(F)c(F)c(F)c2F)cc1
PDB
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603515
PNG
(CHEMBL5195141)
Show SMILES CC(C)N(Cc1ccc(cn1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
PDB
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603516
PNG
(CHEMBL5202595)
Show SMILES CC(C)CN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
PDB
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603517
PNG
(CHEMBL5191960)
Show SMILES COCCN(Cc1ccc(cc1)C(=O)NO)S(=O)(=O)c1cc(F)c(F)c(F)c1F
PDB
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
Histone deacetylase 8


(Homo sapiens (Human))
BDBM50603511
PNG
(CHEMBL5173782)
Show SMILES CC(C)N(Cc1ccc(cc1)C(=O)NO)Cc1cc(F)c(F)c(F)c1F
PDB
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.1c01585
BindingDB Entry DOI: 10.7270/Q2QV3RKM
More data for this
Ligand-Target Pair
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