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Compile Data Set for Download or QSAR

Found 119 hits with Last Name = 'katoh' and Initial = 'm'   
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
Mineralocorticoid receptor


(RAT)
BDBM50004519
PNG
(CHEMBL2181929)
Show SMILES CC1(C)Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H17FN2O4S/c1-17(2)16(21)20(13-7-4-11(18)5-8-13)14-9-6-12(10-15(14)24-17)19-25(3,22)23/h4-10,19H,1-3H3
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31n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50318300
PNG
(CHEMBL1095097 | EPLERENONE | SC-66110)
Show SMILES COC(=O)[C@@H]1CC2=CC(=O)CC[C@]2(C)[C@@]23O[C@@H]2C[C@@]2(C)[C@@H](CC[C@@]22CCC(=O)O2)[C@H]13 |r,t:6|
Show InChI InChI=1S/C24H30O6/c1-21-7-4-14(25)10-13(21)11-15(20(27)28-3)19-16-5-8-23(9-6-18(26)30-23)22(16,2)12-17-24(19,21)29-17/h10,15-17,19H,4-9,11-12H2,1-3H3/t15-,16+,17-,19+,21+,22+,23-,24-/m1/s1
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44n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597078
PNG
(CHEMBL5181002)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(Cc1ccccc1)c1ccccc1
PDB
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597086
PNG
(CHEMBL5187656)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C3(CCC3)Oc2c1)c1ccc(F)cc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597084
PNG
(CHEMBL5174401)
Show SMILES CC1Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597087
PNG
(CHEMBL5181278)
Show SMILES CC1(C)CN(c2ccc(F)cc2)c2ccc(NS(C)(=O)=O)cc2O1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597084
PNG
(CHEMBL5174401)
Show SMILES CC1Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597083
PNG
(CHEMBL5171957)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C(Oc2c1)c1ccccc1)c1ccc(F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597083
PNG
(CHEMBL5171957)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C(Oc2c1)c1ccccc1)c1ccc(F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597078
PNG
(CHEMBL5181002)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(Cc1ccccc1)c1ccccc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597087
PNG
(CHEMBL5181278)
Show SMILES CC1(C)CN(c2ccc(F)cc2)c2ccc(NS(C)(=O)=O)cc2O1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50366432
PNG
(CHEMBL1627263)
Show SMILES CCC(CS(=N)(=O)CCC(=N)C(O)=O)C(O)=O
Show InChI InChI=1S/C9H18N2O5S/c1-2-6(8(12)13)5-17(11,16)4-3-7(10)9(14)15/h6,10,17H,2-5H2,1H3,(H2,11,16)(H,12,13)(H,14,15)
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390n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 5.1 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597085
PNG
(CHEMBL5183454)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C3(CC3)Oc2c1)c1ccc(F)cc1
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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597081
PNG
(CHEMBL5184647)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccc(F)cc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597077
PNG
(CHEMBL5172350)
Show SMILES CCN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597081
PNG
(CHEMBL5184647)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccc(F)cc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597086
PNG
(CHEMBL5187656)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C3(CCC3)Oc2c1)c1ccc(F)cc1
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626n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597076
PNG
(CHEMBL5176336)
Show SMILES CN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597068
PNG
(CHEMBL5201004)
Show SMILES CC(C)(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
PDB
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597085
PNG
(CHEMBL5183454)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C3(CC3)Oc2c1)c1ccc(F)cc1
PDB
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TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597076
PNG
(CHEMBL5176336)
Show SMILES CN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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853n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597080
PNG
(CHEMBL5207249)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccccc1
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1.24E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597080
PNG
(CHEMBL5207249)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccccc1
PDB
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1.27E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597073
PNG
(CHEMBL5182687)
Show SMILES CNS(=O)(=O)c1ccc(cc1)C(C)(C)c1ccccc1
PDB
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1.37E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597077
PNG
(CHEMBL5172350)
Show SMILES CCN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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1.56E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597082
PNG
(CHEMBL5204612)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)COc2c1)c1ccc(F)cc1
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1.75E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(Homo sapiens (Human))
BDBM50597070
PNG
(CHEMBL5186524)
Show SMILES CCS(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1
PDB
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1.92E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597068
PNG
(CHEMBL5201004)
Show SMILES CC(C)(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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1.96E+3n/an/an/an/an/an/an/an/a


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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597070
PNG
(CHEMBL5186524)
Show SMILES CCS(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1
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3.77E+3n/an/an/an/an/an/an/an/a


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Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597073
PNG
(CHEMBL5182687)
Show SMILES CNS(=O)(=O)c1ccc(cc1)C(C)(C)c1ccccc1
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4.31E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50287274
PNG
((2S)-2-ammonio-4-[(2-carboxylatobutyl)phosphinato]...)
Show SMILES CCC(CP([O-])(=O)CC[C@H]([NH3+])C([O-])=O)C([O-])=O
Show InChI InChI=1S/C9H18NO6P/c1-2-6(8(11)12)5-17(15,16)4-3-7(10)9(13)14/h6-7H,2-5,10H2,1H3,(H,11,12)(H,13,14)(H,15,16)/p-2/t6?,7-/m0/s1
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4.95E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 5.7 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597079
PNG
(CHEMBL5207123)
Show SMILES CC(=O)c1ccc(cc1)N(Cc1ccccc1)c1ccc(NS(C)(=O)=O)cc1
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5.67E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597071
PNG
(CHEMBL5191961)
Show SMILES CN(C)S(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1
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6.88E+3n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50287275
PNG
(2-ammonio-4-[(2-carboxylatobutyl)sulfonyl]butanoat...)
Show SMILES CCC(CS(=O)(=O)CCC([NH3+])C([O-])=O)C([O-])=O
Show InChI InChI=1S/C9H17NO6S/c1-2-6(8(11)12)5-17(15,16)4-3-7(10)9(13)14/h6-7H,2-5,10H2,1H3,(H,11,12)(H,13,14)/p-1
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9.23E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 16.3 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Mineralocorticoid receptor


(RAT)
BDBM50597074
PNG
(CHEMBL5197264)
Show SMILES CC(C)(c1ccccc1)c1cccc(NS(C)(=O)=O)c1
PDB

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1.20E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597074
PNG
(CHEMBL5197264)
Show SMILES CC(C)(c1ccccc1)c1cccc(NS(C)(=O)=O)c1
PDB

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1.96E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597080
PNG
(CHEMBL5207249)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccccc1
PDB

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2.22E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597079
PNG
(CHEMBL5207123)
Show SMILES CC(=O)c1ccc(cc1)N(Cc1ccccc1)c1ccc(NS(C)(=O)=O)cc1
PDB

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2.54E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597071
PNG
(CHEMBL5191961)
Show SMILES CN(C)S(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1
PDB

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2.90E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597078
PNG
(CHEMBL5181002)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(Cc1ccccc1)c1ccccc1
PDB

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2.91E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597070
PNG
(CHEMBL5186524)
Show SMILES CCS(=O)(=O)Nc1ccc(cc1)C(C)(C)c1ccccc1
PDB

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3.79E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597068
PNG
(CHEMBL5201004)
Show SMILES CC(C)(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
PDB

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4.00E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597081
PNG
(CHEMBL5184647)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)N(C(=O)c1ccccc1)c1ccc(F)cc1
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4.15E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597087
PNG
(CHEMBL5181278)
Show SMILES CC1(C)CN(c2ccc(F)cc2)c2ccc(NS(C)(=O)=O)cc2O1
PDB

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4.32E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597077
PNG
(CHEMBL5172350)
Show SMILES CCN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
PDB

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4.50E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597076
PNG
(CHEMBL5176336)
Show SMILES CN(c1ccccc1)c1ccc(NS(C)(=O)=O)cc1
PDB

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4.72E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glutamate--cysteine ligase catalytic subunit


(Homo sapiens (Human))
BDBM50366433
PNG
(CHEMBL1609891)
Show SMILES CCCCS(=N)(=O)CCC(=N)C(O)=O
Show InChI InChI=1S/C8H18N2O3S/c1-2-3-5-14(10,13)6-4-7(9)8(11)12/h9,14H,2-6H2,1H3,(H2,10,13)(H,11,12)
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KEGG

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DrugBank
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4.93E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for inhibition of Escherichia coli gamma-glutamylcysteine synthetase at a concentration of 25.0 uM


Bioorg Med Chem Lett 6: 1437-1442 (1996)


Article DOI: 10.1016/S0960-894X(96)00247-8
BindingDB Entry DOI: 10.7270/Q2KH0NV4
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597083
PNG
(CHEMBL5171957)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)C(Oc2c1)c1ccccc1)c1ccc(F)cc1
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5.52E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50004519
PNG
(CHEMBL2181929)
Show SMILES CC1(C)Oc2cc(NS(C)(=O)=O)ccc2N(C1=O)c1ccc(F)cc1
Show InChI InChI=1S/C17H17FN2O4S/c1-17(2)16(21)20(13-7-4-11(18)5-8-13)14-9-6-12(10-15(14)24-17)19-25(3,22)23/h4-10,19H,1-3H3
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CHEMBL
MCE
PC cid
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UniChem
Article
PubMed
8.42E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
Glucocorticoid receptor


(RAT)
BDBM50597082
PNG
(CHEMBL5204612)
Show SMILES CS(=O)(=O)Nc1ccc2N(C(=O)COc2c1)c1ccc(F)cc1
PDB

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>1.00E+5n/an/an/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jmedchem.2c00402
BindingDB Entry DOI: 10.7270/Q2571H1M
More data for this
Ligand-Target Pair
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