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Compile Data Set for Download or QSAR

Found 853 hits Enz. Inhib. hit(s) with Target = '11-beta-hydroxysteroid dehydrogenase 2'   
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 2


(Homo sapiens (human))
BDBM29830
PNG
(spiro-carboxamide scaffold, 3)
Show SMILES Clc1ccc(cc1)C1(CC1)C(=O)N1CCC2(CCc3ccccc23)C1
Show InChI InChI=1S/C22H22ClNO/c23-18-7-5-17(6-8-18)22(11-12-22)20(25)24-14-13-21(15-24)10-9-16-3-1-2-4-19(16)21/h1-8H,9-15H2
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n/an/a>1.00E+5n/an/an/an/a7.822



Merck-Serono



Assay Description
11beta-HSD2 enzyme activity was assessed in buffer containing NAD, test compound, and human recombinant 11beta-HSD2 expressed in E. coli. Reaction wa...


Bioorg Med Chem Lett 19: 3682-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.123
BindingDB Entry DOI: 10.7270/Q2X065DQ
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM29832
PNG
(spiro-carboxamide scaffold, 5)
Show SMILES Clc1ccc(cc1)C1(CC1)C(=O)N1CCC2(C1)CCCc1ccccc21
Show InChI InChI=1S/C23H24ClNO/c24-19-9-7-18(8-10-19)23(12-13-23)21(26)25-15-14-22(16-25)11-3-5-17-4-1-2-6-20(17)22/h1-2,4,6-10H,3,5,11-16H2
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n/an/a>1.00E+5n/an/an/an/a7.822



Merck-Serono



Assay Description
11beta-HSD2 enzyme activity was assessed in buffer containing NAD, test compound, and human recombinant 11beta-HSD2 expressed in E. coli. Reaction wa...


Bioorg Med Chem Lett 19: 3682-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.123
BindingDB Entry DOI: 10.7270/Q2X065DQ
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM29833
PNG
(spiro-carboxamide scaffold, 6)
Show SMILES Clc1ccc(cc1)C1(CC1)C(=O)N1CCC2(C1)CCCCC2
Show InChI InChI=1S/C19H24ClNO/c20-16-6-4-15(5-7-16)19(10-11-19)17(22)21-13-12-18(14-21)8-2-1-3-9-18/h4-7H,1-3,8-14H2
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n/an/a>1.00E+5n/an/an/an/a7.822



Merck-Serono



Assay Description
11beta-HSD2 enzyme activity was assessed in buffer containing NAD, test compound, and human recombinant 11beta-HSD2 expressed in E. coli. Reaction wa...


Bioorg Med Chem Lett 19: 3682-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.123
BindingDB Entry DOI: 10.7270/Q2X065DQ
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM29840
PNG
(spiro-carboxamide scaffold, 13)
Show SMILES O=C(N1CCC2(C1)CCCCC2)C1(CC1)c1ccccc1
Show InChI InChI=1S/C19H25NO/c21-17(19(11-12-19)16-7-3-1-4-8-16)20-14-13-18(15-20)9-5-2-6-10-18/h1,3-4,7-8H,2,5-6,9-15H2
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n/an/a>1.00E+5n/an/an/an/a7.822



Merck-Serono



Assay Description
11beta-HSD2 enzyme activity was assessed in buffer containing NAD, test compound, and human recombinant 11beta-HSD2 expressed in E. coli. Reaction wa...


Bioorg Med Chem Lett 19: 3682-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.02.123
BindingDB Entry DOI: 10.7270/Q2X065DQ
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM50216917
PNG
(2-(cyclooctylamino)-5,5-diethyloxazol-4(5H)-one | ...)
Show SMILES CCC1(CC)OC(NC2CCCCCCC2)=NC1=O
Show InChI InChI=1S/C15H26N2O2/c1-3-15(4-2)13(18)17-14(19-15)16-12-10-8-6-5-7-9-11-12/h12H,3-11H2,1-2H3,(H,16,17,18)
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>1.00E+4n/an/an/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Binding affinity to human 11beta-HSD2


Bioorg Med Chem Lett 17: 4837-40 (2007)


Article DOI: 10.1016/j.bmcl.2007.06.054
BindingDB Entry DOI: 10.7270/Q2MP52ZC
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM50210884
PNG
(1-(1-(3-methoxy-4-methylbenzoyl)piperidin-4-yl)-1H...)
Show SMILES COc1cc(ccc1C)C(=O)N1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C21H23N3O3/c1-14-7-8-15(13-19(14)27-2)20(25)23-11-9-16(10-12-23)24-18-6-4-3-5-17(18)22-21(24)26/h3-8,13,16H,9-12H2,1-2H3,(H,22,26)
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>1.00E+4n/an/an/an/an/an/an/an/a



Biovitrum AB

Curated by ChEMBL


Assay Description
Inhibition of 11betaHSD2


Bioorg Med Chem Lett 17: 3421-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.083
BindingDB Entry DOI: 10.7270/Q2GX4B72
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM50317206
PNG
((3-Phenyl-adamantan-1-yl)-piperidin-1-yl-methanone...)
Show SMILES O=C(N1CCCCC1)C12CC3CC(C1)CC(C3)(C2)c1ccccc1
Show InChI InChI=1S/C22H29NO/c24-20(23-9-5-2-6-10-23)22-14-17-11-18(15-22)13-21(12-17,16-22)19-7-3-1-4-8-19/h1,3-4,7-8,17-18H,2,5-6,9-16H2
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>1.00E+4n/an/an/an/an/an/an/an/a



Pfizer Global Research& Development

Curated by ChEMBL


Assay Description
Inhibition of 11-beta-HSD2


Bioorg Med Chem Lett 20: 2897-902 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.032
BindingDB Entry DOI: 10.7270/Q2NV9JDJ
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM50185127
PNG
((3beta,20beta)-20-carboxy-11-oxo-30-norolean-12-en...)
Show SMILES CC1(C)[C@H](CC[C@@]2(C)[C@H]1CC[C@]1(C)[C@@H]2C(=O)C=C2[C@@H]3C[C@](C)(CC[C@]3(C)CC[C@@]12C)C(O)=O)O[C@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O[C@@H]1O[C@@H]([C@@H](O)[C@H](O)[C@H]1O)C(O)=O)C(O)=O
Show InChI InChI=1S/C42H62O16/c1-37(2)21-8-11-42(7)31(20(43)16-18-19-17-39(4,36(53)54)13-12-38(19,3)14-15-41(18,42)6)40(21,5)10-9-22(37)55-35-30(26(47)25(46)29(57-35)33(51)52)58-34-27(48)23(44)24(45)28(56-34)32(49)50/h16,19,21-31,34-35,44-48H,8-15,17H2,1-7H3,(H,49,50)(H,51,52)(H,53,54)/t19-,21-,22-,23-,24-,25-,26-,27+,28-,29-,30+,31+,34-,35-,38+,39-,40-,41+,42+/m0/s1
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n/an/a 1n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human microsomal 11beta-HSD2 expressed in HEK293 cells assessed as conversion of [3H]cortisone to [3H]cortisol by scintillation proximi...


Bioorg Med Chem Lett 19: 4455-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.05.033
BindingDB Entry DOI: 10.7270/Q2VT1T1D
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13755
PNG
((1R,3R,4S,7S)-4-(2-methyl-2-phenoxypropanamido)ada...)
Show SMILES CC(C)(Oc1ccccc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H27NO4/c1-20(2,26-16-6-4-3-5-7-16)18(23)22-17-14-8-13-9-15(17)12-21(10-13,11-14)19(24)25/h3-7,13-15,17H,8-12H2,1-2H3,(H,22,23)(H,24,25)/t13-,14+,15?,17+,21+/m0/s1
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n/an/a 1.70E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13756
PNG
((1R,3R,4S,7S)-4-(2-methyl-2-phenoxypropanamido)ada...)
Show SMILES CC(C)(Oc1ccccc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(N)=O
Show InChI InChI=1S/C21H28N2O3/c1-20(2,26-16-6-4-3-5-7-16)19(25)23-17-14-8-13-9-15(17)12-21(10-13,11-14)18(22)24/h3-7,13-15,17H,8-12H2,1-2H3,(H2,22,24)(H,23,25)/t13-,14+,15?,17+,21+/m0/s1
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n/an/a 2.30E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13757
PNG
((1R,3R,4S,7S)-4-[2-(2-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccccc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-6-4-3-5-15(16)22)18(24)23-17-13-7-12-8-14(17)11-21(9-12,10-13)19(25)26/h3-6,12-14,17H,7-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13758
PNG
((1R,3R,4S,7S)-4-[2-(3-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1cccc(Cl)c1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-5-3-4-15(22)8-16)18(24)23-17-13-6-12-7-14(17)11-21(9-12,10-13)19(25)26/h3-5,8,12-14,17H,6-7,9-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 3.50E+3n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13759
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-5-3-15(22)4-6-16)18(24)23-17-13-7-12-8-14(17)11-21(9-12,10-13)19(25)26/h3-6,12-14,17H,7-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 3.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13760
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(N)=O
Show InChI InChI=1S/C21H27ClN2O3/c1-20(2,27-16-5-3-15(22)4-6-16)19(26)24-17-13-7-12-8-14(17)11-21(9-12,10-13)18(23)25/h3-6,12-14,17H,7-11H2,1-2H3,(H2,23,25)(H,24,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13761
PNG
((1R,3R,4S,7S)-4-[2-(4-methoxyphenoxy)-2-methylprop...)
Show SMILES COc1ccc(OC(C)(C)C(=O)N[C@H]2C3C[C@@H]4C[C@@H]2C[C@](C4)(C3)C(N)=O)cc1
Show InChI InChI=1S/C22H30N2O4/c1-21(2,28-17-6-4-16(27-3)5-7-17)20(26)24-18-14-8-13-9-15(18)12-22(10-13,11-14)19(23)25/h4-7,13-15,18H,8-12H2,1-3H3,(H2,23,25)(H,24,26)/t13-,14+,15?,18+,22+/m0/s1
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n/an/a 1.80E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13762
PNG
(4-({[(1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methyl...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C29H33ClN2O5/c1-28(2,37-23-9-7-22(30)8-10-23)26(35)32-24-20-11-18-12-21(24)15-29(13-18,14-20)27(36)31-16-17-3-5-19(6-4-17)25(33)34/h3-10,18,20-21,24H,11-16H2,1-2H3,(H,31,36)(H,32,35)(H,33,34)/t18-,20+,21?,24+,29+/m0/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13763
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C30H36ClN3O6S/c1-29(2,40-24-10-8-23(31)9-11-24)27(36)33-25-21-12-19-13-22(25)16-30(14-19,15-21)28(37)32-17-18-4-6-20(7-5-18)26(35)34-41(3,38)39/h4-11,19,21-22,25H,12-17H2,1-3H3,(H,32,37)(H,33,36)(H,34,35)/t19-,21+,22?,25+,30+/m0/s1
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n/an/a 5.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13764
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C29H33ClN6O3/c1-28(2,39-23-9-7-22(30)8-10-23)26(37)32-24-20-11-18-12-21(24)15-29(13-18,14-20)27(38)31-16-17-3-5-19(6-4-17)25-33-35-36-34-25/h3-10,18,20-21,24H,11-16H2,1-2H3,(H,31,38)(H,32,37)(H,33,34,35,36)/t18-,20+,21?,24+,29+/m0/s1
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n/an/a 2.60E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13765
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C28H34ClN3O5S/c1-27(2,37-22-7-5-21(29)6-8-22)25(33)32-24-19-11-18-12-20(24)15-28(13-18,14-19)26(34)31-16-17-3-9-23(10-4-17)38(30,35)36/h3-10,18-20,24H,11-16H2,1-2H3,(H,31,34)(H,32,33)(H2,30,35,36)/t18-,19+,20?,24+,28+/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13766
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1cncs1
Show InChI InChI=1S/C25H30ClN3O3S/c1-24(2,32-19-5-3-18(26)4-6-19)22(30)29-21-16-7-15-8-17(21)11-25(9-15,10-16)23(31)28-13-20-12-27-14-33-20/h3-6,12,14-17,21H,7-11,13H2,1-2H3,(H,28,31)(H,29,30)/t15-,16+,17?,21+,25+/m0/s1
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n/an/a 1.30E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13767
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccncc1
Show InChI InChI=1S/C27H32ClN3O3/c1-26(2,34-22-5-3-21(28)4-6-22)24(32)31-23-19-11-18-12-20(23)15-27(13-18,14-19)25(33)30-16-17-7-9-29-10-8-17/h3-10,18-20,23H,11-16H2,1-2H3,(H,30,33)(H,31,32)/t18-,19+,20?,23+,27+/m0/s1
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n/an/a 5.30E+3n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13768
PNG
(N-[(1R,2S,5R,7S)-5-[(carbamoylmethyl)carbamoyl]ada...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCC(N)=O
Show InChI InChI=1S/C23H30ClN3O4/c1-22(2,31-17-5-3-16(24)4-6-17)20(29)27-19-14-7-13-8-15(19)11-23(9-13,10-14)21(30)26-12-18(25)28/h3-6,13-15,19H,7-12H2,1-2H3,(H2,25,28)(H,26,30)(H,27,29)/t13-,14+,15?,19+,23+/m0/s1
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n/an/a 2.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13769
PNG
(2-(4-chlorophenoxy)-2-methyl-N-[(1R,2S,5R,7S)-5-{[...)
Show SMILES CNC(=O)NC(=O)[C@@]12C[C@@H]3CC(C1)[C@H](NC(=O)C(C)(C)Oc1ccc(Cl)cc1)[C@H](C3)C2
Show InChI InChI=1S/C23H30ClN3O4/c1-22(2,31-17-6-4-16(24)5-7-17)19(28)26-18-14-8-13-9-15(18)12-23(10-13,11-14)20(29)27-21(30)25-3/h4-7,13-15,18H,8-12H2,1-3H3,(H,26,28)(H2,25,27,29,30)/t13-,14+,15?,18+,23+/m0/s1
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n/an/a 1.20E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13770
PNG
(2-(4-chlorophenoxy)-N-[(1R,2S,5R,7S)-5-(hydroxymet...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](CO)(C3)C2
Show InChI InChI=1S/C21H28ClNO3/c1-20(2,26-17-5-3-16(22)4-6-17)19(25)23-18-14-7-13-8-15(18)11-21(9-13,10-14)12-24/h3-6,13-15,18,24H,7-12H2,1-2H3,(H,23,25)/t13-,14+,15?,18+,21+/m0/s1
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n/an/a 2.50E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13771
PNG
(2-{[(1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylp...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](COCC(O)=O)(C3)C2
Show InChI InChI=1S/C23H30ClNO5/c1-22(2,30-18-5-3-17(24)4-6-18)21(28)25-20-15-7-14-8-16(20)11-23(9-14,10-15)13-29-12-19(26)27/h3-6,14-16,20H,7-13H2,1-2H3,(H,25,28)(H,26,27)/t14-,15+,16?,20+,23+/m0/s1
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13772
PNG
(2-(2-chloro-4-fluorophenoxy)-2-methyl-N-[(1R,2S,5R...)
Show SMILES CC(C)(Oc1ccc(F)cc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)c1nnn[nH]1
Show InChI InChI=1S/C21H25ClFN5O2/c1-20(2,30-16-4-3-14(23)7-15(16)22)19(29)24-17-12-5-11-6-13(17)10-21(8-11,9-12)18-25-27-28-26-18/h3-4,7,11-13,17H,5-6,8-10H2,1-2H3,(H,24,29)(H,25,26,27,28)/t11-,12+,13?,17+,21+/m0/s1
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n/an/a 550n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM13773
PNG
((1R,3R,4S,7S)-4-[2-(2-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccccc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H29ClN2O5S/c1-21(2,30-17-7-5-4-6-16(17)23)19(26)24-18-14-8-13-9-15(18)12-22(10-13,11-14)20(27)25-31(3,28)29/h4-7,13-15,18H,8-12H2,1-3H3,(H,24,26)(H,25,27)/t13-,14+,15?,18+,22+/m0/s1
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Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13755
PNG
((1R,3R,4S,7S)-4-(2-methyl-2-phenoxypropanamido)ada...)
Show SMILES CC(C)(Oc1ccccc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H27NO4/c1-20(2,26-16-6-4-3-5-7-16)18(23)22-17-14-8-13-9-15(17)12-21(10-13,11-14)19(24)25/h3-7,13-15,17H,8-12H2,1-2H3,(H,22,23)(H,24,25)/t13-,14+,15?,17+,21+/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13756
PNG
((1R,3R,4S,7S)-4-(2-methyl-2-phenoxypropanamido)ada...)
Show SMILES CC(C)(Oc1ccccc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(N)=O
Show InChI InChI=1S/C21H28N2O3/c1-20(2,26-16-6-4-3-5-7-16)19(25)23-17-14-8-13-9-15(17)12-21(10-13,11-14)18(22)24/h3-7,13-15,17H,8-12H2,1-2H3,(H2,22,24)(H,23,25)/t13-,14+,15?,17+,21+/m0/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13757
PNG
((1R,3R,4S,7S)-4-[2-(2-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccccc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-6-4-3-5-15(16)22)18(24)23-17-13-7-12-8-14(17)11-21(9-12,10-13)19(25)26/h3-6,12-14,17H,7-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 140n/an/an/an/an/an/a



Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13758
PNG
((1R,3R,4S,7S)-4-[2-(3-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1cccc(Cl)c1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-5-3-4-15(22)8-16)18(24)23-17-13-6-12-7-14(17)11-21(9-12,10-13)19(25)26/h3-5,8,12-14,17H,6-7,9-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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Abbott Laboratories



Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13759
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(O)=O
Show InChI InChI=1S/C21H26ClNO4/c1-20(2,27-16-5-3-15(22)4-6-16)18(24)23-17-13-7-12-8-14(17)11-21(9-12,10-13)19(25)26/h3-6,12-14,17H,7-11H2,1-2H3,(H,23,24)(H,25,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 1.70E+3n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13760
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(N)=O
Show InChI InChI=1S/C21H27ClN2O3/c1-20(2,27-16-5-3-15(22)4-6-16)19(26)24-17-13-7-12-8-14(17)11-21(9-12,10-13)18(23)25/h3-6,12-14,17H,7-11H2,1-2H3,(H2,23,25)(H,24,26)/t12-,13+,14?,17+,21+/m0/s1
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n/an/a 4.00E+4n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13761
PNG
((1R,3R,4S,7S)-4-[2-(4-methoxyphenoxy)-2-methylprop...)
Show SMILES COc1ccc(OC(C)(C)C(=O)N[C@H]2C3C[C@@H]4C[C@@H]2C[C@](C4)(C3)C(N)=O)cc1
Show InChI InChI=1S/C22H30N2O4/c1-21(2,28-17-6-4-16(27-3)5-7-17)20(26)24-18-14-8-13-9-15(18)12-22(10-13,11-14)19(23)25/h4-7,13-15,18H,8-12H2,1-3H3,(H2,23,25)(H,24,26)/t13-,14+,15?,18+,22+/m0/s1
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n/an/a 5.50E+4n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13762
PNG
(4-({[(1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methyl...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C29H33ClN2O5/c1-28(2,37-23-9-7-22(30)8-10-23)26(35)32-24-20-11-18-12-21(24)15-29(13-18,14-20)27(36)31-16-17-3-5-19(6-4-17)25(33)34/h3-10,18,20-21,24H,11-16H2,1-2H3,(H,31,36)(H,32,35)(H,33,34)/t18-,20+,21?,24+,29+/m0/s1
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n/an/a 5.80E+3n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13763
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C30H36ClN3O6S/c1-29(2,40-24-10-8-23(31)9-11-24)27(36)33-25-21-12-19-13-22(25)16-30(14-19,15-21)28(37)32-17-18-4-6-20(7-5-18)26(35)34-41(3,38)39/h4-11,19,21-22,25H,12-17H2,1-3H3,(H,32,37)(H,33,36)(H,34,35)/t19-,21+,22?,25+,30+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13764
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C29H33ClN6O3/c1-28(2,39-23-9-7-22(30)8-10-23)26(37)32-24-20-11-18-12-21(24)15-29(13-18,14-20)27(38)31-16-17-3-5-19(6-4-17)25-33-35-36-34-25/h3-10,18,20-21,24H,11-16H2,1-2H3,(H,31,38)(H,32,37)(H,33,34,35,36)/t18-,20+,21?,24+,29+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13765
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C28H34ClN3O5S/c1-27(2,37-22-7-5-21(29)6-8-22)25(33)32-24-19-11-18-12-20(24)15-28(13-18,14-19)26(34)31-16-17-3-9-23(10-4-17)38(30,35)36/h3-10,18-20,24H,11-16H2,1-2H3,(H,31,34)(H,32,33)(H2,30,35,36)/t18-,19+,20?,24+,28+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13766
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1cncs1
Show InChI InChI=1S/C25H30ClN3O3S/c1-24(2,32-19-5-3-18(26)4-6-19)22(30)29-21-16-7-15-8-17(21)11-25(9-15,10-16)23(31)28-13-20-12-27-14-33-20/h3-6,12,14-17,21H,7-11,13H2,1-2H3,(H,28,31)(H,29,30)/t15-,16+,17?,21+,25+/m0/s1
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n/an/a 2.10E+4n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13767
PNG
((1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCc1ccncc1
Show InChI InChI=1S/C27H32ClN3O3/c1-26(2,34-22-5-3-21(28)4-6-22)24(32)31-23-19-11-18-12-20(23)15-27(13-18,14-19)25(33)30-16-17-7-9-29-10-8-17/h3-10,18-20,23H,11-16H2,1-2H3,(H,30,33)(H,31,32)/t18-,19+,20?,23+,27+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13768
PNG
(N-[(1R,2S,5R,7S)-5-[(carbamoylmethyl)carbamoyl]ada...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NCC(N)=O
Show InChI InChI=1S/C23H30ClN3O4/c1-22(2,31-17-5-3-16(24)4-6-17)20(29)27-19-14-7-13-8-15(19)11-23(9-13,10-14)21(30)26-12-18(25)28/h3-6,13-15,19H,7-12H2,1-2H3,(H2,25,28)(H,26,30)(H,27,29)/t13-,14+,15?,19+,23+/m0/s1
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n/an/a 9.00E+4n/an/an/an/an/an/a



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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13769
PNG
(2-(4-chlorophenoxy)-2-methyl-N-[(1R,2S,5R,7S)-5-{[...)
Show SMILES CNC(=O)NC(=O)[C@@]12C[C@@H]3CC(C1)[C@H](NC(=O)C(C)(C)Oc1ccc(Cl)cc1)[C@H](C3)C2
Show InChI InChI=1S/C23H30ClN3O4/c1-22(2,31-17-6-4-16(24)5-7-17)19(28)26-18-14-8-13-9-15(18)12-23(10-13,11-14)20(29)27-21(30)25-3/h4-7,13-15,18H,8-12H2,1-3H3,(H,26,28)(H2,25,27,29,30)/t13-,14+,15?,18+,23+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13770
PNG
(2-(4-chlorophenoxy)-N-[(1R,2S,5R,7S)-5-(hydroxymet...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](CO)(C3)C2
Show InChI InChI=1S/C21H28ClNO3/c1-20(2,26-17-5-3-16(22)4-6-17)19(25)23-18-14-7-13-8-15(18)11-21(9-13,10-14)12-24/h3-6,13-15,18,24H,7-12H2,1-2H3,(H,23,25)/t13-,14+,15?,18+,21+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13771
PNG
(2-{[(1R,3R,4S,7S)-4-[2-(4-chlorophenoxy)-2-methylp...)
Show SMILES CC(C)(Oc1ccc(Cl)cc1)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](COCC(O)=O)(C3)C2
Show InChI InChI=1S/C23H30ClNO5/c1-22(2,30-18-5-3-17(24)4-6-18)21(28)25-20-15-7-14-8-16(20)11-23(9-14,10-15)13-29-12-19(26)27/h3-6,14-16,20H,7-13H2,1-2H3,(H,25,28)(H,26,27)/t14-,15+,16?,20+,23+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13772
PNG
(2-(2-chloro-4-fluorophenoxy)-2-methyl-N-[(1R,2S,5R...)
Show SMILES CC(C)(Oc1ccc(F)cc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)c1nnn[nH]1
Show InChI InChI=1S/C21H25ClFN5O2/c1-20(2,30-16-4-3-14(23)7-15(16)22)19(29)24-17-12-5-11-6-13(17)10-21(8-11,9-12)18-25-27-28-26-18/h3-4,7,11-13,17H,5-6,8-10H2,1-2H3,(H,24,29)(H,25,26,27,28)/t11-,12+,13?,17+,21+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-Hydroxysteroid Dehydrogenase 2 (11-beta-HSD2)


(Mus musculus (mouse))
BDBM13773
PNG
((1R,3R,4S,7S)-4-[2-(2-chlorophenoxy)-2-methylpropa...)
Show SMILES CC(C)(Oc1ccccc1Cl)C(=O)N[C@H]1C2C[C@@H]3C[C@@H]1C[C@](C3)(C2)C(=O)NS(C)(=O)=O
Show InChI InChI=1S/C22H29ClN2O5S/c1-21(2,30-17-7-5-4-6-16(17)23)19(26)24-18-14-8-13-9-15(18)12-22(10-13,11-14)20(27)25-31(3,28)29/h4-7,13-15,18H,8-12H2,1-3H3,(H,24,26)(H,25,27)/t13-,14+,15?,18+,22+/m0/s1
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Assay Description
The in Vitro 11beta-HSD2 dehydrogenase assays were developed using the cell lysates that had the full length human or mouse 11beta-HSD2 cDNA over exp...


Bioorg Med Chem Lett 17: 750-5 (2007)


Article DOI: 10.1016/j.bmcl.2006.10.074
BindingDB Entry DOI: 10.7270/Q2W66J13
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM22456
PNG
(2-(cycloheptylamino)-5-ethyl-5-methyl-4,5-dihydro-...)
Show SMILES CCC1(C)SC(NC2CCCCCC2)=NC1=O
Show InChI InChI=1S/C13H22N2OS/c1-3-13(2)11(16)15-12(17-13)14-10-8-6-4-5-7-9-10/h10H,3-9H2,1-2H3,(H,14,15,16)
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Assay Description
The assay was performed at room temperature in a 96-well microtiter plate containing substrate mixture [3H]cortisol/NAD+, inhibitors, and 11beta-HSD2...


J Med Chem 51: 2933-43 (2008)


Article DOI: 10.1021/jm701551j
BindingDB Entry DOI: 10.7270/Q2HM56Q8
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM22457
PNG
(2-(cycloheptylamino)-5-methyl-5-propyl-4,5-dihydro...)
Show SMILES CCCC1(C)SC(NC2CCCCCC2)=NC1=O
Show InChI InChI=1S/C14H24N2OS/c1-3-10-14(2)12(17)16-13(18-14)15-11-8-6-4-5-7-9-11/h11H,3-10H2,1-2H3,(H,15,16,17)
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Assay Description
The assay was performed at room temperature in a 96-well microtiter plate containing substrate mixture [3H]cortisol/NAD+, inhibitors, and 11beta-HSD2...


J Med Chem 51: 2933-43 (2008)


Article DOI: 10.1021/jm701551j
BindingDB Entry DOI: 10.7270/Q2HM56Q8
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM22458
PNG
(2-(cyclooctylamino)-5-ethyl-5-methyl-4,5-dihydro-1...)
Show SMILES CCC1(C)SC(NC2CCCCCCC2)=NC1=O
Show InChI InChI=1S/C14H24N2OS/c1-3-14(2)12(17)16-13(18-14)15-11-9-7-5-4-6-8-10-11/h11H,3-10H2,1-2H3,(H,15,16,17)
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Assay Description
The assay was performed at room temperature in a 96-well microtiter plate containing substrate mixture [3H]cortisol/NAD+, inhibitors, and 11beta-HSD2...


J Med Chem 51: 2933-43 (2008)


Article DOI: 10.1021/jm701551j
BindingDB Entry DOI: 10.7270/Q2HM56Q8
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 2


(Homo sapiens (human))
BDBM22459
PNG
(2-(cyclooctylamino)-5-methyl-5-propyl-4,5-dihydro-...)
Show SMILES CCCC1(C)SC(NC2CCCCCCC2)=NC1=O
Show InChI InChI=1S/C15H26N2OS/c1-3-11-15(2)13(18)17-14(19-15)16-12-9-7-5-4-6-8-10-12/h12H,3-11H2,1-2H3,(H,16,17,18)
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Biovitrum AB



Assay Description
The assay was performed at room temperature in a 96-well microtiter plate containing substrate mixture [3H]cortisol/NAD+, inhibitors, and 11beta-HSD2...


J Med Chem 51: 2933-43 (2008)


Article DOI: 10.1021/jm701551j
BindingDB Entry DOI: 10.7270/Q2HM56Q8
More data for this
Ligand-Target Pair
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