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PubMed code 23353742

Compile data set for download or QSAR
Found 29 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
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429327
PNG
(CHEMBL2334144)
Show SMILES Cc1c(Cl)cccc1S(=O)(=O)N1CCC[C@@H](C1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C19H27ClN2O3S/c1-14-17(20)10-5-11-18(14)26(24,25)22-12-6-7-15(13-22)19(23)21-16-8-3-2-4-9-16/h5,10-11,15-16H,2-4,6-9,12-13H2,1H3,(H,21,23)/t15-/m0/s1
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PubMed
n/an/a 0.800n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429315
PNG
(CHEMBL2334168)
Show SMILES Cc1c(Br)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C21H20BrN3O2/c1-14-17(10-5-11-18(14)22)21(26)25-12-6-9-16(13-25)20-23-19(24-27-20)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3/t16-/m0/s1
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n/an/a 3.30n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429322
PNG
(CHEMBL2334176)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C21H20ClN3O2/c1-14-17(10-5-11-18(14)22)21(26)25-12-6-9-16(13-25)20-23-19(24-27-20)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3/t16-/m0/s1
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n/an/a 27n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429316
PNG
(CHEMBL2334169)
Show SMILES Cc1cccc(C(=O)N2CCC[C@@H](C2)c2nc(no2)-c2ccccc2)c1Cl
Show InChI InChI=1S/C21H20ClN3O2/c1-14-7-5-11-17(18(14)22)21(26)25-12-6-10-16(13-25)20-23-19(24-27-20)15-8-3-2-4-9-15/h2-5,7-9,11,16H,6,10,12-13H2,1H3/t16-/m0/s1
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n/an/a 28n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429310
PNG
(CHEMBL2334159)
Show SMILES O=C(C1CCCCC1)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C20H25N3O2/c24-20(16-10-5-2-6-11-16)23-13-7-12-17(14-23)19-21-18(22-25-19)15-8-3-1-4-9-15/h1,3-4,8-9,16-17H,2,5-7,10-14H2/t17-/m0/s1
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n/an/a 71n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429308
PNG
(CHEMBL2334157)
Show SMILES O=C(C1CC1)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C17H19N3O2/c21-17(13-8-9-13)20-10-4-7-14(11-20)16-18-15(19-22-16)12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2/t14-/m0/s1
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n/an/a 92n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429323
PNG
(CHEMBL2334175)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1noc(n1)-c1ccccc1
Show InChI InChI=1S/C21H20ClN3O2/c1-14-17(10-5-11-18(14)22)21(26)25-12-6-9-16(13-25)19-23-20(27-24-19)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3/t16-/m0/s1
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n/an/a 107n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429312
PNG
(CHEMBL2334162)
Show SMILES Cn1ccc2c(cccc12)C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C23H22N4O2/c1-26-14-12-18-19(10-5-11-20(18)26)23(28)27-13-6-9-17(15-27)22-24-21(25-29-22)16-7-3-2-4-8-16/h2-5,7-8,10-12,14,17H,6,9,13,15H2,1H3/t17-/m0/s1
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n/an/a 141n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429302
PNG
(CHEMBL2334148)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1Cl
Show InChI InChI=1S/C21H19Cl2N3O2/c1-13-15(8-4-10-17(13)22)21(27)26-11-5-6-14(12-26)20-24-19(25-28-20)16-7-2-3-9-18(16)23/h2-4,7-10,14H,5-6,11-12H2,1H3/t14-/m0/s1
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n/an/a 277n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429317
PNG
(CHEMBL2334170)
Show SMILES Clc1ccc(cc1)C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C20H18ClN3O2/c21-17-10-8-15(9-11-17)20(25)24-12-4-7-16(13-24)19-22-18(23-26-19)14-5-2-1-3-6-14/h1-3,5-6,8-11,16H,4,7,12-13H2/t16-/m0/s1
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n/an/a 277n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429300
PNG
(CHEMBL2334146)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1cccc(Br)c1
Show InChI InChI=1S/C21H19BrClN3O2/c1-13-17(8-3-9-18(13)23)21(27)26-10-4-6-15(12-26)20-24-19(25-28-20)14-5-2-7-16(22)11-14/h2-3,5,7-9,11,15H,4,6,10,12H2,1H3/t15-/m0/s1
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n/an/a 310n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429309
PNG
(CHEMBL2334158)
Show SMILES O=C(C1CCC1)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C18H21N3O2/c22-18(14-8-4-9-14)21-11-5-10-15(12-21)17-19-16(20-23-17)13-6-2-1-3-7-13/h1-3,6-7,14-15H,4-5,8-12H2/t15-/m0/s1
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n/an/a 326n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429320
PNG
(CHEMBL2334173)
Show SMILES Cc1ccccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C21H21N3O2/c1-15-8-5-6-12-18(15)21(25)24-13-7-11-17(14-24)20-22-19(23-26-20)16-9-3-2-4-10-16/h2-6,8-10,12,17H,7,11,13-14H2,1H3/t17-/m0/s1
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n/an/a 435n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429324
PNG
(CHEMBL2334177)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)n1nnc(n1)-c1ccccc1
Show InChI InChI=1S/C20H20ClN5O/c1-14-17(10-5-11-18(14)21)20(27)25-12-6-9-16(13-25)26-23-19(22-24-26)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3/t16-/m0/s1
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n/an/a 594n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429306
PNG
(CHEMBL2334151)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)C1CCCCC1
Show InChI InChI=1S/C21H26ClN3O2/c1-14-17(10-5-11-18(14)22)21(26)25-12-6-9-16(13-25)20-23-19(24-27-20)15-7-3-2-4-8-15/h5,10-11,15-16H,2-4,6-9,12-13H2,1H3/t16-/m0/s1
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n/an/a 621n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429314
PNG
(CHEMBL2334165)
Show SMILES O=C(N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1)c1ccco1
Show InChI InChI=1S/C18H17N3O3/c22-18(15-9-5-11-23-15)21-10-4-8-14(12-21)17-19-16(20-24-17)13-6-2-1-3-7-13/h1-3,5-7,9,11,14H,4,8,10,12H2/t14-/m0/s1
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n/an/a 659n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429313
PNG
(CHEMBL2334163)
Show SMILES Cn1cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C19H20N4O2/c1-22-11-6-10-16(22)19(24)23-12-5-9-15(13-23)18-20-17(21-25-18)14-7-3-2-4-8-14/h2-4,6-8,10-11,15H,5,9,12-13H2,1H3/t15-/m0/s1
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n/an/a 715n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429318
PNG
(CHEMBL2334171)
Show SMILES Clc1cccc(c1)C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C20H18ClN3O2/c21-17-10-4-8-15(12-17)20(25)24-11-5-9-16(13-24)19-22-18(23-26-19)14-6-2-1-3-7-14/h1-4,6-8,10,12,16H,5,9,11,13H2/t16-/m0/s1
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n/an/a 741n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429307
PNG
(CHEMBL2334156)
Show SMILES CC1(C)C(C(=O)N2CCC[C@@H](C2)c2nc(no2)-c2ccccc2)C1(C)C
Show InChI InChI=1S/C21H27N3O2/c1-20(2)16(21(20,3)4)19(25)24-12-8-11-15(13-24)18-22-17(23-26-18)14-9-6-5-7-10-14/h5-7,9-10,15-16H,8,11-13H2,1-4H3/t15-/m0/s1
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n/an/a 793n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429301
PNG
(CHEMBL2334147)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1Br
Show InChI InChI=1S/C21H19BrClN3O2/c1-13-15(8-4-10-18(13)23)21(27)26-11-5-6-14(12-26)20-24-19(25-28-20)16-7-2-3-9-17(16)22/h2-4,7-10,14H,5-6,11-12H2,1H3/t14-/m0/s1
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n/an/a 825n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429319
PNG
(CHEMBL2334172)
Show SMILES Clc1ccccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C20H18ClN3O2/c21-17-11-5-4-10-16(17)20(25)24-12-6-9-15(13-24)19-22-18(23-26-19)14-7-2-1-3-8-14/h1-5,7-8,10-11,15H,6,9,12-13H2/t15-/m0/s1
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n/an/a 853n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429325
PNG
(CHEMBL2334179)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nnc([nH]1)-c1ccccc1
Show InChI InChI=1S/C21H21ClN4O/c1-14-17(10-5-11-18(14)22)21(27)26-12-6-9-16(13-26)20-23-19(24-25-20)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3,(H,23,24,25)/t16-/m0/s1
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n/an/a 945n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429303
PNG
(CHEMBL2334150)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccc(F)cc1
Show InChI InChI=1S/C21H19ClFN3O2/c1-13-17(5-2-6-18(13)22)21(27)26-11-3-4-15(12-26)20-24-19(25-28-20)14-7-9-16(23)10-8-14/h2,5-10,15H,3-4,11-12H2,1H3/t15-/m0/s1
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n/an/a 956n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429305
PNG
(CHEMBL2334152)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)C12CC3CC(CC(C3)C1)C2
Show InChI InChI=1S/C25H30ClN3O2/c1-15-20(5-2-6-21(15)26)23(30)29-7-3-4-19(14-29)22-27-24(28-31-22)25-11-16-8-17(12-25)10-18(9-16)13-25/h2,5-6,16-19H,3-4,7-14H2,1H3/t16?,17?,18?,19-,25?/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429304
PNG
(CHEMBL2334149)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1cccs1
Show InChI InChI=1S/C19H18ClN3O2S/c1-12-14(6-2-7-15(12)20)19(24)23-9-3-5-13(11-23)18-21-17(22-25-18)16-8-4-10-26-16/h2,4,6-8,10,13H,3,5,9,11H2,1H3/t13-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429299
PNG
(CHEMBL2334145)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nc(no1)-c1ccc(Br)cc1
Show InChI InChI=1S/C21H19BrClN3O2/c1-13-17(5-2-6-18(13)23)21(27)26-11-3-4-15(12-26)20-24-19(25-28-20)14-7-9-16(22)10-8-14/h2,5-10,15H,3-4,11-12H2,1H3/t15-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429326
PNG
(CHEMBL2334180)
Show SMILES Cc1c(Cl)cccc1C(=O)N1CCC[C@@H](C1)c1nnc(o1)-c1ccccc1
Show InChI InChI=1S/C21H20ClN3O2/c1-14-17(10-5-11-18(14)22)21(26)25-12-6-9-16(13-25)20-24-23-19(27-20)15-7-3-2-4-8-15/h2-5,7-8,10-11,16H,6,9,12-13H2,1H3/t16-/m0/s1
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n/an/a 1.32E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429311
PNG
(CHEMBL2334160)
Show SMILES O=C(C1CCCCCC1)N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C21H27N3O2/c25-21(17-11-4-1-2-5-12-17)24-14-8-13-18(15-24)20-22-19(23-26-20)16-9-6-3-7-10-16/h3,6-7,9-10,17-18H,1-2,4-5,8,11-15H2/t18-/m0/s1
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n/an/a 1.48E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (Human))
BDBM50429321
PNG
(CHEMBL2334174)
Show SMILES O=C(N1CCC[C@@H](C1)c1nc(no1)-c1ccccc1)c1ccccc1
Show InChI InChI=1S/C20H19N3O2/c24-20(16-10-5-2-6-11-16)23-13-7-12-17(14-23)19-21-18(22-25-19)15-8-3-1-4-9-15/h1-6,8-11,17H,7,12-14H2/t17-/m0/s1
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n/an/a 2.37E+3n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human 11-beta HSD1 transfected in HEK293 cell microsomes assessed as decrease in [3H]cortisol generation using [3H]cortisone as substra...


Eur J Med Chem 62: 1-10 (2013)


Article DOI: 10.1016/j.ejmech.2012.12.059
BindingDB Entry DOI: 10.7270/Q2GH9K9M
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%