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Compile Data Set for Download or QSAR

Found 342 hits of ph data with Target = '11-beta-hydroxysteroid dehydrogenase 1'   
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))
BDBM99418
PNG
(US8497281, 196 | US9120769, 129)
Show SMILES Cn1cnc2ccc(cc12)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C21H21N3O/c1-23-13-22-18-9-8-15(12-20(18)23)21(25)24-10-4-7-17-16-6-3-2-5-14(16)11-19(17)24/h2-3,5-6,8-9,12-13,17,19H,4,7,10-11H2,1H3/t17?,19-/m0/s1
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n/an/a 1.49E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99419
PNG
(US8497281, 197 | US9120769, 130)
Show SMILES Nc1cc(ccc1F)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H19FN2O/c20-16-8-7-13(10-17(16)21)19(23)22-9-3-6-15-14-5-2-1-4-12(14)11-18(15)22/h1-2,4-5,7-8,10,15,18H,3,6,9,11,21H2/t15?,18-/m0/s1
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n/an/a 1.14E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99420
PNG
(US8497281, 131 | US9120769, 131)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1ccn2ccnc2c1
Show InChI InChI=1S/C20H19N3O/c24-20(15-7-10-22-11-8-21-19(22)13-15)23-9-3-6-17-16-5-2-1-4-14(16)12-18(17)23/h1-2,4-5,7-8,10-11,13,17-18H,3,6,9,12H2/t17?,18-/m0/s1
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n/an/a 6.43E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99421
PNG
(US8497281, 199 | US9120769, 132)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1ccc2[nH]ncc2c1
Show InChI InChI=1S/C20H19N3O/c24-20(14-7-8-18-15(10-14)12-21-22-18)23-9-3-6-17-16-5-2-1-4-13(16)11-19(17)23/h1-2,4-5,7-8,10,12,17,19H,3,6,9,11H2,(H,21,22)/t17?,19-/m0/s1
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n/an/a 320n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99422
PNG
(US8497281, 200 | US9120769, 133)
Show SMILES Nc1ccc(cc1)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H20N2O/c20-15-9-7-13(8-10-15)19(22)21-11-3-6-17-16-5-2-1-4-14(16)12-18(17)21/h1-2,4-5,7-10,17-18H,3,6,11-12,20H2/t17?,18-/m0/s1
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n/an/a 854n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99423
PNG
(US8497281, 201 | US9120769, 134)
Show SMILES Oc1ccc(cc1)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H19NO2/c21-15-9-7-13(8-10-15)19(22)20-11-3-6-17-16-5-2-1-4-14(16)12-18(17)20/h1-2,4-5,7-10,17-18,21H,3,6,11-12H2/t17?,18-/m0/s1
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n/an/a 389n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99424
PNG
(US8497281, 202 | US9120769, 135)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C21H20N2O/c24-21(16-7-8-19-15(12-16)9-10-22-19)23-11-3-6-18-17-5-2-1-4-14(17)13-20(18)23/h1-2,4-5,7-10,12,18,20,22H,3,6,11,13H2/t18?,20-/m0/s1
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n/an/a 585n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99425
PNG
(US8497281, 203 | US9120769, 136)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1c[nH]c2ccccc12
Show InChI InChI=1S/C21H20N2O/c24-21(18-13-22-19-10-4-3-8-16(18)19)23-11-5-9-17-15-7-2-1-6-14(15)12-20(17)23/h1-4,6-8,10,13,17,20,22H,5,9,11-12H2/t17?,20-/m0/s1
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n/an/a 527n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99426
PNG
(US8497281, 204 | US9120769, 137)
Show SMILES Oc1c(Cl)cc(cc1Cl)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H17Cl2NO2/c20-15-8-12(9-16(21)18(15)23)19(24)22-7-3-6-14-13-5-2-1-4-11(13)10-17(14)22/h1-2,4-5,8-9,14,17,23H,3,6-7,10H2/t14?,17-/m0/s1
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n/an/a 1.12E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99427
PNG
(US8497281, 205)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1ccc2nn[nH]c2c1
Show InChI InChI=1S/C19H18N4O/c24-19(13-7-8-16-17(10-13)21-22-20-16)23-9-3-6-15-14-5-2-1-4-12(14)11-18(15)23/h1-2,4-5,7-8,10,15,18H,3,6,9,11H2,(H,20,21,22)/t15?,18-/m0/s1
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n/an/a 1.05E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99428
PNG
(US8497281, 206 | US9120769, 139)
Show SMILES Cn1cc(C(=O)N2CCCC3[C@@H]2Cc2ccccc32)c2ccccc12
Show InChI InChI=1S/C22H22N2O/c1-23-14-19(18-9-4-5-11-20(18)23)22(25)24-12-6-10-17-16-8-3-2-7-15(16)13-21(17)24/h2-5,7-9,11,14,17,21H,6,10,12-13H2,1H3/t17?,21-/m0/s1
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n/an/a 484n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99429
PNG
(US8497281, 207 | US9120769, 140)
Show SMILES COc1ccc(cc1O)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C20H21NO3/c1-24-19-9-8-14(12-18(19)22)20(23)21-10-4-7-16-15-6-3-2-5-13(15)11-17(16)21/h2-3,5-6,8-9,12,16-17,22H,4,7,10-11H2,1H3/t16?,17-/m0/s1
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n/an/a 1.62E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99430
PNG
(US8497281, 208 | US9120769, 141)
Show SMILES Oc1ccc(cc1Cl)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H18ClNO2/c20-16-10-13(7-8-18(16)22)19(23)21-9-3-6-15-14-5-2-1-4-12(14)11-17(15)21/h1-2,4-5,7-8,10,15,17,22H,3,6,9,11H2/t15?,17-/m0/s1
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n/an/a 326n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99431
PNG
(US8497281, 209 | US9120769, 142)
Show SMILES Nc1cc(ccc1Cl)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H19ClN2O/c20-16-8-7-13(10-17(16)21)19(23)22-9-3-6-15-14-5-2-1-4-12(14)11-18(15)22/h1-2,4-5,7-8,10,15,18H,3,6,9,11,21H2/t15?,18-/m0/s1
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n/an/a 996n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99432
PNG
(US8497281, 210 | US9120769, 143)
Show SMILES Cc1ccc(cc1N)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C20H22N2O/c1-13-8-9-15(11-18(13)21)20(23)22-10-4-7-17-16-6-3-2-5-14(16)12-19(17)22/h2-3,5-6,8-9,11,17,19H,4,7,10,12,21H2,1H3/t17?,19-/m0/s1
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n/an/a 1.41E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99433
PNG
(US8497281, 211 | US9120769, 144)
Show SMILES COc1cc(ccc1N)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C20H22N2O2/c1-24-19-12-14(8-9-17(19)21)20(23)22-10-4-7-16-15-6-3-2-5-13(15)11-18(16)22/h2-3,5-6,8-9,12,16,18H,4,7,10-11,21H2,1H3/t16?,18-/m0/s1
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n/an/a 609n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99434
PNG
(US8497281, 212 | US9120769, 145)
Show SMILES Nc1ccc(cc1F)C(=O)N1CCCC2[C@@H]1Cc1ccccc21
Show InChI InChI=1S/C19H19FN2O/c20-16-10-13(7-8-17(16)21)19(23)22-9-3-6-15-14-5-2-1-4-12(14)11-18(15)22/h1-2,4-5,7-8,10,15,18H,3,6,9,11,21H2/t15?,18-/m0/s1
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n/an/a 777n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99435
PNG
(US8497281, 213)
Show SMILES C[C@H]1CCN([C@H]2Cc3ccccc3[C@@H]12)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C21H21N3O/c1-13-8-9-24(19-11-14-4-2-3-5-16(14)20(13)19)21(25)15-6-7-17-18(10-15)23-12-22-17/h2-7,10,12-13,19-20H,8-9,11H2,1H3,(H,22,23)/t13-,19-,20+/m0/s1
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n/an/a 55n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99436
PNG
(US8497281, 147 | US9120769, 147)
Show SMILES O=C(N1CCCC2[C@@H]1Cc1ccccc21)c1ccc2[nH]c(=O)cnc2c1
Show InChI InChI=1S/C21H19N3O2/c25-20-12-22-18-10-14(7-8-17(18)23-20)21(26)24-9-3-6-16-15-5-2-1-4-13(15)11-19(16)24/h1-2,4-5,7-8,10,12,16,19H,3,6,9,11H2,(H,23,25)/t16?,19-/m0/s1
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n/an/a 1.74E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99437
PNG
(US8497281, 215)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1cc(ccc21)C#N)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C21H18N4O/c22-11-13-3-5-16-15(8-13)10-20-17(16)2-1-7-25(20)21(26)14-4-6-18-19(9-14)24-12-23-18/h3-6,8-9,12,17,20H,1-2,7,10H2,(H,23,24)/t17-,20+/m1/s1
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n/an/a 214n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99438
PNG
(US8497281, 216)
Show SMILES COc1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C21H21N3O2/c1-26-15-6-4-13-10-20-16(17(13)11-15)3-2-8-24(20)21(25)14-5-7-18-19(9-14)23-12-22-18/h4-7,9,11-12,16,20H,2-3,8,10H2,1H3,(H,22,23)/t16-,20+/m1/s1
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n/an/a 141n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99439
PNG
(US8497281, 217)
Show SMILES Oc1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C20H19N3O2/c24-14-5-3-12-9-19-15(16(12)10-14)2-1-7-23(19)20(25)13-4-6-17-18(8-13)22-11-21-17/h3-6,8,10-11,15,19,24H,1-2,7,9H2,(H,21,22)/t15-,19+/m1/s1
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n/an/a 674n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99440
PNG
(US8497281, 218)
Show SMILES Nc1ccc2[C@H]3CCCN([C@H]3Cc2c1)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C20H20N4O/c21-14-4-5-15-13(8-14)10-19-16(15)2-1-7-24(19)20(25)12-3-6-17-18(9-12)23-11-22-17/h3-6,8-9,11,16,19H,1-2,7,10,21H2,(H,22,23)/t16-,19+/m1/s1
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n/an/a 188n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99441
PNG
(US8497281, 219)
Show SMILES Cc1cc(cc2[nH]cnc12)C(=O)N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#N
Show InChI InChI=1S/C22H20N4O/c1-13-7-16(9-19-21(13)25-12-24-19)22(27)26-6-2-3-17-18-8-14(11-23)4-5-15(18)10-20(17)26/h4-5,7-9,12,17,20H,2-3,6,10H2,1H3,(H,24,25)/t17-,20+/m1/s1
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n/an/a 24n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99442
PNG
(US8497281, 220)
Show SMILES Cc1cc2nc[nH]c2cc1C(=O)N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#N
Show InChI InChI=1S/C22H20N4O/c1-13-7-19-20(25-12-24-19)10-17(13)22(27)26-6-2-3-16-18-8-14(11-23)4-5-15(18)9-21(16)26/h4-5,7-8,10,12,16,21H,2-3,6,9H2,1H3,(H,24,25)/t16-,21+/m1/s1
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n/an/a 48n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99443
PNG
(US8497281, 221)
Show SMILES COC(=O)c1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C22H21N3O3/c1-28-22(27)15-5-4-13-11-20-16(17(13)9-15)3-2-8-25(20)21(26)14-6-7-18-19(10-14)24-12-23-18/h4-7,9-10,12,16,20H,2-3,8,11H2,1H3,(H,23,24)/t16-,20+/m1/s1
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n/an/a 449n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99444
PNG
(US8497281, 222)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#C)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C22H19N3O/c1-2-14-5-6-15-12-21-17(18(15)10-14)4-3-9-25(21)22(26)16-7-8-19-20(11-16)24-13-23-19/h1,5-8,10-11,13,17,21H,3-4,9,12H2,(H,23,24)/t17-,21+/m1/s1
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n/an/a 83n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99445
PNG
(US8497281, 223)
Show SMILES OCc1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C21H21N3O2/c25-11-13-3-4-14-10-20-16(17(14)8-13)2-1-7-24(20)21(26)15-5-6-18-19(9-15)23-12-22-18/h3-6,8-9,12,16,20,25H,1-2,7,10-11H2,(H,22,23)/t16-,20+/m1/s1
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n/an/a 432n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99446
PNG
(US8497281, 224)
Show SMILES CC(C)(O)c1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C23H25N3O2/c1-23(2,28)16-7-5-14-11-21-17(18(14)12-16)4-3-9-26(21)22(27)15-6-8-19-20(10-15)25-13-24-19/h5-8,10,12-13,17,21,28H,3-4,9,11H2,1-2H3,(H,24,25)/t17-,21+/m1/s1
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n/an/a 1.16E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99447
PNG
(US8497281, 225)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)-c1ccccc1)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C26H23N3O/c30-26(20-10-11-23-24(14-20)28-16-27-23)29-12-4-7-21-22-13-18(17-5-2-1-3-6-17)8-9-19(22)15-25(21)29/h1-3,5-6,8-11,13-14,16,21,25H,4,7,12,15H2,(H,27,28)/t21-,25+/m1/s1
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n/an/a 998n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99448
PNG
(US8497281, 159)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C#Cc1ccccc1)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C28H23N3O/c32-28(22-12-13-25-26(16-22)30-18-29-25)31-14-4-7-23-24-15-20(10-11-21(24)17-27(23)31)9-8-19-5-2-1-3-6-19/h1-3,5-6,10-13,15-16,18,23,27H,4,7,14,17H2,(H,29,30)/t23-,27+/m1/s1
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n/an/a 1.79E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99449
PNG
(US8497281, 227)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)-c1ccoc1)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C24H21N3O2/c28-24(17-5-6-21-22(11-17)26-14-25-21)27-8-1-2-19-20-10-15(18-7-9-29-13-18)3-4-16(20)12-23(19)27/h3-7,9-11,13-14,19,23H,1-2,8,12H2,(H,25,26)/t19-,23+/m1/s1
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n/an/a 367n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99450
PNG
(US8497281, 228)
Show SMILES CC#Cc1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C23H21N3O/c1-2-4-15-6-7-16-13-22-18(19(16)11-15)5-3-10-26(22)23(27)17-8-9-20-21(12-17)25-14-24-20/h6-9,11-12,14,18,22H,3,5,10,13H2,1H3,(H,24,25)/t18-,22+/m1/s1
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n/an/a 212n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99451
PNG
(US8497281, 229)
Show SMILES Cn1cc(cn1)-c1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C24H23N5O/c1-28-13-18(12-27-28)15-4-5-16-11-23-19(20(16)9-15)3-2-8-29(23)24(30)17-6-7-21-22(10-17)26-14-25-21/h4-7,9-10,12-14,19,23H,2-3,8,11H2,1H3,(H,25,26)/t19-,23+/m1/s1
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n/an/a 354n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99452
PNG
(US8497281, 230)
Show SMILES Cc1ccc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2c1
Show InChI InChI=1S/C21H21N3O/c1-13-4-5-14-11-20-16(17(14)9-13)3-2-8-24(20)21(25)15-6-7-18-19(10-15)23-12-22-18/h4-7,9-10,12,16,20H,2-3,8,11H2,1H3,(H,22,23)/t16-,20+/m1/s1
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n/an/a 67n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99453
PNG
(US8497281, 231)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C1CCOCC1)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C25H27N3O2/c29-25(19-5-6-22-23(13-19)27-15-26-22)28-9-1-2-20-21-12-17(16-7-10-30-11-8-16)3-4-18(21)14-24(20)28/h3-6,12-13,15-16,20,24H,1-2,7-11,14H2,(H,26,27)/t20-,24+/m1/s1
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n/an/a 1.32E+3n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99454
PNG
(US8497281, 232)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1ccc(cc21)C1CCCC1)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C25H27N3O/c29-25(19-9-10-22-23(13-19)27-15-26-22)28-11-3-6-20-21-12-17(16-4-1-2-5-16)7-8-18(21)14-24(20)28/h7-10,12-13,15-16,20,24H,1-6,11,14H2,(H,26,27)/t20-,24+/m1/s1
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n/an/a 449n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99455
PNG
(US8497281, 233)
Show SMILES CC(=O)Nc1ccc2[C@H]3CCCN([C@H]3Cc2c1)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C22H22N4O2/c1-13(27)25-16-5-6-17-15(9-16)11-21-18(17)3-2-8-26(21)22(28)14-4-7-19-20(10-14)24-12-23-19/h4-7,9-10,12,18,21H,2-3,8,11H2,1H3,(H,23,24)(H,25,27)/t18-,21+/m1/s1
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n/an/a 182n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99456
PNG
(US8497281, 234)
Show SMILES CS(=O)(=O)Nc1ccc2[C@H]3CCCN([C@H]3Cc2c1)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C21H22N4O3S/c1-29(27,28)24-15-5-6-16-14(9-15)11-20-17(16)3-2-8-25(20)21(26)13-4-7-18-19(10-13)23-12-22-18/h4-7,9-10,12,17,20,24H,2-3,8,11H2,1H3,(H,22,23)/t17-,20+/m1/s1
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n/an/a 573n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99457
PNG
(US8497281, 235)
Show SMILES Oc1cc2[C@H]3CCCN([C@H]3Cc2cc1[N+]([O-])=O)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C20H18N4O4/c25-19-9-14-12(8-18(19)24(27)28)7-17-13(14)2-1-5-23(17)20(26)11-3-4-15-16(6-11)22-10-21-15/h3-4,6,8-10,13,17,25H,1-2,5,7H2,(H,21,22)/t13-,17+/m1/s1
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n/an/a 313n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99458
PNG
(US8497281, 236)
Show SMILES Nc1cc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1O
Show InChI InChI=1S/C20H20N4O2/c21-15-6-12-8-18-13(14(12)9-19(15)25)2-1-5-24(18)20(26)11-3-4-16-17(7-11)23-10-22-16/h3-4,6-7,9-10,13,18,25H,1-2,5,8,21H2,(H,22,23)/t13-,18+/m1/s1
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n/an/a 429n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99459
PNG
(US8497281, 237)
Show SMILES Cc1nc2cc3C[C@H]4[C@H](CCCN4C(=O)c4ccc5nc[nH]c5c4)c3cc2o1
Show InChI InChI=1S/C22H20N4O2/c1-12-25-19-8-14-9-20-15(16(14)10-21(19)28-12)3-2-6-26(20)22(27)13-4-5-17-18(7-13)24-11-23-17/h4-5,7-8,10-11,15,20H,2-3,6,9H2,1H3,(H,23,24)/t15-,20+/m1/s1
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n/an/a 248n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99460
PNG
(US8497281, 238)
Show SMILES O=C(N1CCC[C@H]2[C@@H]1Cc1cc3ncoc3cc21)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C21H18N4O2/c26-21(12-3-4-16-17(6-12)23-10-22-16)25-5-1-2-14-15-9-20-18(24-11-27-20)7-13(15)8-19(14)25/h3-4,6-7,9-11,14,19H,1-2,5,8H2,(H,22,23)/t14-,19+/m1/s1
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n/an/a 218n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99463
PNG
(US8497281, 241)
Show SMILES Cc1cc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1C#N
Show InChI InChI=1S/C22H20N4O/c1-13-7-15-10-21-17(18(15)8-16(13)11-23)3-2-6-26(21)22(27)14-4-5-19-20(9-14)25-12-24-19/h4-5,7-9,12,17,21H,2-3,6,10H2,1H3,(H,24,25)/t17-,21+/m1/s1
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n/an/a 67n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99461
PNG
(US8497281, 239)
Show SMILES COc1cc2[C@H]3CCCN([C@H]3Cc2cc1C)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C22H23N3O2/c1-13-8-15-10-20-16(17(15)11-21(13)27-2)4-3-7-25(20)22(26)14-5-6-18-19(9-14)24-12-23-18/h5-6,8-9,11-12,16,20H,3-4,7,10H2,1-2H3,(H,23,24)/t16-,20+/m1/s1
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n/an/a 5.60n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99462
PNG
(US8497281, 240)
Show SMILES Cc1cc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1O
Show InChI InChI=1S/C21H21N3O2/c1-12-7-14-9-19-15(16(14)10-20(12)25)3-2-6-24(19)21(26)13-4-5-17-18(8-13)23-11-22-17/h4-5,7-8,10-11,15,19,25H,2-3,6,9H2,1H3,(H,22,23)/t15-,19+/m1/s1
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n/an/a 18.6n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99463
PNG
(US8497281, 241)
Show SMILES Cc1cc2C[C@H]3[C@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1C#N
Show InChI InChI=1S/C22H20N4O/c1-13-7-15-10-21-17(18(15)8-16(13)11-23)3-2-6-26(21)22(27)14-4-5-19-20(9-14)25-12-24-19/h4-5,7-9,12,17,21H,2-3,6,10H2,1H3,(H,24,25)/t17-,21+/m1/s1
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n/an/a 3.60n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99464
PNG
(US8497281, 242)
Show SMILES Cc1c2[C@H]3CCCN([C@H]3Cc2ccc1C#N)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C22H20N4O/c1-13-16(11-23)5-4-14-10-20-17(21(13)14)3-2-8-26(20)22(27)15-6-7-18-19(9-15)25-12-24-18/h4-7,9,12,17,20H,2-3,8,10H2,1H3,(H,24,25)/t17-,20-/m0/s1
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n/an/a 46.5n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99465
PNG
(US8497281, 243)
Show SMILES Cc1cc2C[C@@H]3[C@@H](CCCN3C(=O)c3ccc4nc[nH]c4c3)c2cc1C#N
Show InChI InChI=1S/C22H20N4O/c1-13-7-15-10-21-17(18(15)8-16(13)11-23)3-2-6-26(21)22(27)14-4-5-19-20(9-14)25-12-24-19/h4-5,7-9,12,17,21H,2-3,6,10H2,1H3,(H,24,25)/t17-,21+/m0/s1
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n/an/a 58.4n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1


(Homo sapiens (human))
BDBM99466
PNG
(US8497281, 244)
Show SMILES Cc1c2[C@@H]3CCCN([C@@H]3Cc2ccc1C#N)C(=O)c1ccc2nc[nH]c2c1
Show InChI InChI=1S/C22H20N4O/c1-13-16(11-23)5-4-14-10-20-17(21(13)14)3-2-8-26(20)22(27)15-6-7-18-19(9-15)25-12-24-18/h4-7,9,12,17,20H,2-3,8,10H2,1H3,(H,24,25)/t17-,20-/m1/s1
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n/an/a>100n/an/an/an/a6.037



Vitae Pharmaceuticals, Inc.; Boehringer Ingelheim International GmbH

US Patent


Assay Description
In vitro inhibition of 11beta-HSD1 by test compounds is determined with HTRF (Homogeneous Time-Resolved Fluoresence) technology (cisbio international...


US Patent US8497281 (2013)


BindingDB Entry DOI: 10.7270/Q2G44NXT
More data for this
Ligand-Target Pair
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