Found 45 hits of Enzyme Inhibition Constant Data Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448230
(CHEMBL3120819)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)cc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.35,-34.25,;34.58,-32.91,;34.17,-34.39,;35.91,-32.14,;37.24,-32.91,;37.25,-34.45,;38.58,-32.14,;39.84,-33.01,;41.19,-32.53,;40.15,-33.77,;40.17,-35.35,;38.67,-35.78,;39.86,-34.5,;41.19,-34.98,;42.58,-34.63,;41.58,-35.91,;42.59,-33.1,;43.92,-35.4,;45.25,-34.63,;43.92,-36.94,;33.24,-32.15,;31.91,-32.92,;31.14,-34.25,;32.68,-34.25,;30.57,-32.15,;30.57,-30.6,;29.23,-29.84,;27.9,-30.61,;26.57,-29.84,;27.9,-32.15,;29.24,-32.92,;29.24,-34.46,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)17-4-3-15(23)7-16(17)24)11-18(28)26-19-13-5-12-6-14(19)10-22(8-12,9-13)20(25)29/h3-4,7,12-14,19,27H,5-6,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448235
(CHEMBL3120758)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,29:26:23:21.20.19,(48.96,-12.34,;48.96,-10.8,;47.63,-10.03,;46.29,-10.8,;47.63,-8.49,;48.96,-7.71,;50.29,-8.48,;50.3,-10.03,;51.63,-10.8,;50.86,-12.13,;52.4,-12.13,;52.96,-10.02,;54.3,-10.79,;55.07,-12.13,;53.89,-12.27,;55.63,-10.02,;56.97,-10.79,;56.97,-12.33,;58.3,-10.02,;59.56,-10.89,;60.91,-10.41,;59.88,-11.65,;59.89,-13.23,;58.39,-13.66,;59.58,-12.38,;60.91,-12.86,;62.31,-12.51,;61.3,-13.79,;62.31,-10.98,;63.66,-13.24,;64.97,-12.44,;63.7,-14.78,)| Show InChI InChI=1S/C23H32ClN3O4S/c1-13-17(24)5-4-6-18(13)32(30,31)27-22(2,3)12-19(28)26-20-15-7-14-8-16(20)11-23(9-14,10-15)21(25)29/h4-6,14-16,20,27H,7-12H2,1-3H3,(H2,25,29)(H,26,28)/t14?,15?,16?,20-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448225
(CHEMBL3120824)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1c(F)cc(F)cc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.27,-35.23,;34.5,-33.9,;34.09,-35.38,;35.83,-33.13,;37.16,-33.9,;37.17,-35.44,;38.5,-33.12,;39.76,-34,;41.11,-33.51,;40.07,-34.76,;40.09,-36.34,;38.59,-36.77,;39.78,-35.49,;41.11,-35.97,;42.5,-35.62,;41.5,-36.9,;42.51,-34.09,;43.83,-36.4,;45.17,-35.64,;43.81,-37.94,;33.16,-33.13,;31.83,-33.9,;31.06,-35.24,;32.6,-35.24,;30.49,-33.14,;29.16,-33.91,;29.16,-35.45,;27.82,-33.14,;27.83,-31.59,;26.49,-30.82,;29.15,-30.82,;30.49,-31.59,;31.82,-30.81,)| Show InChI InChI=1S/C22H28F3N3O4S/c1-21(2,28-33(31,32)19-15(24)5-14(23)6-16(19)25)10-17(29)27-18-12-3-11-4-13(18)9-22(7-11,8-12)20(26)30/h5-6,11-13,18,28H,3-4,7-10H2,1-2H3,(H2,26,30)(H,27,29)/t11?,12?,13?,18-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448224
(CHEMBL3120825)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(11.44,-47.23,;10.67,-45.9,;10.26,-47.38,;12,-45.12,;13.33,-45.89,;13.34,-47.43,;14.67,-45.12,;15.93,-46,;17.28,-45.51,;16.25,-46.75,;16.26,-48.34,;14.76,-48.76,;15.95,-47.48,;17.28,-47.96,;18.67,-47.61,;17.67,-48.89,;18.68,-46.08,;20.01,-48.37,;21.34,-47.59,;20.03,-49.91,;9.33,-45.13,;8,-45.9,;7.23,-47.23,;8.77,-47.23,;6.66,-45.13,;6.66,-43.58,;5.32,-42.82,;4,-43.59,;3.99,-45.13,;2.66,-45.9,;5.33,-45.9,)| Show InChI InChI=1S/C22H30ClN3O4S/c1-21(2,26-31(29,30)17-5-3-4-16(23)8-17)12-18(27)25-19-14-6-13-7-15(19)11-22(9-13,10-14)20(24)28/h3-5,8,13-15,19,26H,6-7,9-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448231
(CHEMBL3120818)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1Cl |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(10.27,-32,;9.5,-30.67,;9.09,-32.15,;10.83,-29.9,;12.17,-30.67,;12.17,-32.21,;13.5,-29.9,;14.76,-30.77,;16.11,-30.29,;15.08,-31.53,;15.09,-33.11,;13.59,-33.54,;14.78,-32.26,;16.11,-32.74,;17.51,-32.39,;16.5,-33.67,;17.51,-30.86,;18.86,-33.13,;20.17,-32.33,;18.89,-34.67,;8.17,-29.9,;6.83,-30.68,;6.06,-32.01,;7.6,-32.01,;5.5,-29.91,;5.49,-28.36,;4.16,-27.59,;2.83,-28.36,;2.83,-29.91,;1.49,-30.68,;4.16,-30.68,;4.16,-32.22,)| Show InChI InChI=1S/C22H29Cl2N3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448229
(CHEMBL3120820)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(F)c1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(11.78,-31.4,;11.01,-30.07,;10.6,-31.55,;12.34,-29.3,;13.68,-30.06,;13.68,-31.6,;15.01,-29.29,;16.27,-30.17,;17.62,-29.68,;16.59,-30.92,;16.6,-32.51,;15.1,-32.94,;16.29,-31.65,;17.62,-32.14,;19.01,-31.79,;18.01,-33.06,;19.02,-30.25,;20.35,-32.56,;21.68,-31.79,;20.34,-34.1,;9.67,-29.3,;8.34,-30.07,;7.57,-31.41,;9.11,-31.4,;7.01,-29.3,;7,-27.75,;5.67,-26.99,;4.34,-27.76,;4.34,-29.3,;3,-30.07,;5.67,-30.07,;5.67,-31.61,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448232
(CHEMBL3120817)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(29.03,-26.58,;28.26,-25.25,;27.85,-26.73,;29.59,-24.48,;30.93,-25.25,;30.93,-26.79,;32.26,-24.47,;33.52,-25.35,;34.87,-24.87,;33.84,-26.11,;33.85,-27.69,;32.35,-28.12,;33.54,-26.84,;34.87,-27.32,;36.26,-26.97,;35.26,-28.25,;36.27,-25.44,;37.59,-27.75,;38.93,-26.98,;37.59,-29.29,;26.92,-24.48,;25.59,-25.25,;24.82,-26.59,;26.36,-26.59,;24.26,-24.49,;24.25,-22.94,;22.92,-22.17,;21.59,-22.94,;21.59,-24.49,;20.25,-25.26,;22.92,-25.26,;22.92,-26.8,)| Show InChI InChI=1S/C22H29ClFN3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448221
(CHEMBL3120828)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)cc1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(16.74,-56.49,;15.96,-55.16,;15.56,-56.64,;17.3,-54.38,;18.63,-55.15,;18.63,-56.69,;19.96,-54.38,;21.23,-55.26,;22.57,-54.77,;21.54,-56.01,;21.55,-57.6,;20.05,-58.02,;21.24,-56.74,;22.58,-57.22,;23.97,-56.87,;22.96,-58.15,;23.97,-55.34,;25.29,-57.66,;26.63,-56.9,;25.28,-59.2,;14.63,-54.39,;13.3,-55.16,;12.53,-56.49,;14.07,-56.49,;11.96,-54.39,;10.62,-55.16,;9.29,-54.39,;9.29,-52.85,;7.96,-52.08,;10.62,-52.08,;11.96,-52.84,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-5-3-16(23)4-6-17)12-18(27)25-19-14-7-13-8-15(19)11-22(9-13,10-14)20(24)28/h3-6,13-15,19,26H,7-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 1 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448222
(CHEMBL3120827)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(31.67,-49.6,;30.9,-48.27,;30.49,-49.75,;32.23,-47.5,;33.56,-48.27,;33.57,-49.81,;34.9,-47.5,;36.16,-48.37,;37.51,-47.89,;36.47,-49.13,;36.49,-50.71,;34.99,-51.14,;36.18,-49.86,;37.51,-50.34,;38.9,-49.99,;37.9,-51.27,;38.9,-48.46,;40.27,-50.69,;41.56,-49.85,;40.35,-52.23,;29.56,-47.5,;28.23,-48.28,;27.46,-49.61,;29,-49.61,;26.89,-47.51,;26.89,-45.96,;25.55,-45.19,;24.22,-45.97,;24.22,-47.51,;22.89,-48.28,;25.56,-48.28,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-5-3-4-16(23)8-17)12-18(27)25-19-14-6-13-7-15(19)11-22(9-13,10-14)20(24)28/h3-5,8,13-15,19,26H,6-7,9-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448223
(CHEMBL3120826)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccccc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(34.84,-49.23,;34.06,-47.89,;33.66,-49.38,;35.4,-47.12,;36.73,-47.89,;36.73,-49.43,;38.06,-47.12,;39.33,-48,;40.67,-47.51,;39.64,-48.75,;39.66,-50.34,;38.16,-50.76,;39.35,-49.48,;40.68,-49.96,;42.07,-49.61,;41.06,-50.89,;42.07,-48.08,;43.41,-50.36,;44.74,-49.57,;43.44,-51.9,;32.73,-47.13,;31.4,-47.9,;30.63,-49.23,;32.17,-49.23,;30.06,-47.13,;30.06,-45.58,;28.72,-44.82,;27.39,-45.59,;27.39,-47.13,;28.72,-47.9,;28.72,-49.44,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-6-4-3-5-16(17)23)12-18(27)25-19-14-7-13-8-15(19)11-22(9-13,10-14)20(24)28/h3-6,13-15,19,26H,7-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448226
(CHEMBL3120823)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)c(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(31.84,-41.57,;31.07,-40.23,;30.66,-41.71,;32.4,-39.46,;33.74,-40.23,;33.74,-41.77,;35.07,-39.46,;36.33,-40.33,;37.68,-39.85,;36.65,-41.09,;36.66,-42.67,;35.16,-43.1,;36.35,-41.82,;37.68,-42.3,;39.08,-41.95,;38.07,-43.23,;39.08,-40.42,;40.44,-42.66,;41.74,-41.83,;40.51,-44.2,;29.73,-39.47,;28.4,-40.24,;27.63,-41.57,;29.17,-41.57,;27.07,-39.47,;27.06,-37.92,;25.73,-37.16,;24.4,-37.93,;23.06,-37.16,;24.4,-39.47,;23.06,-40.24,;25.73,-40.24,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)15-3-4-16(23)17(24)7-15)11-18(28)26-19-13-5-12-6-14(19)10-22(8-12,9-13)20(25)29/h3-4,7,12-14,19,27H,5-6,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448227
(CHEMBL3120822)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1c(F)cccc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(10.8,-38.9,;10.03,-37.57,;9.62,-39.05,;11.36,-36.8,;12.7,-37.57,;12.7,-39.11,;14.03,-36.8,;15.29,-37.67,;16.64,-37.19,;15.61,-38.43,;15.62,-40.01,;14.12,-40.44,;15.31,-39.16,;16.64,-39.64,;18.03,-39.29,;17.03,-40.57,;18.04,-37.76,;19.36,-40.07,;20.7,-39.3,;19.36,-41.61,;8.69,-36.8,;7.36,-37.58,;6.59,-38.91,;8.13,-38.91,;6.03,-36.81,;4.69,-37.58,;4.69,-39.12,;3.36,-36.81,;3.36,-35.26,;4.69,-34.49,;6.02,-35.26,;7.35,-34.48,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)19-15(23)4-3-5-16(19)24)11-17(28)26-18-13-6-12-7-14(18)10-22(8-12,9-13)20(25)29/h3-5,12-14,18,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,18-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 2 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448237
(CHEMBL3120755)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2 |r,wU:19.19,wD:26.28,TLB:29:26:23:21.20.19,18:19:23:25.28.26,27:26:23:21.20.19,27:26:23.22.21:19,THB:28:22:19:25.26.29,28:26:23.22.21:19,29:20:23:25.28.26,(61.35,-6.19,;61.35,-4.65,;60.01,-3.88,;58.68,-4.65,;60.01,-2.33,;61.34,-1.56,;62.68,-2.33,;62.68,-3.88,;64.02,-4.65,;63.25,-5.98,;64.79,-5.98,;65.35,-3.87,;66.69,-4.64,;67.46,-5.97,;66.28,-6.12,;68.02,-3.87,;69.35,-4.64,;69.36,-6.18,;70.69,-3.86,;71.95,-4.74,;73.3,-4.26,;72.26,-5.5,;72.28,-7.08,;70.78,-7.51,;71.97,-6.23,;73.3,-6.71,;74.69,-6.36,;76.23,-6.29,;73.68,-7.64,;74.69,-4.83,)| Show InChI InChI=1S/C22H31ClN2O4S/c1-13-17(23)5-4-6-18(13)30(28,29)25-21(2,3)12-19(26)24-20-15-7-14-8-16(20)11-22(27,9-14)10-15/h4-6,14-16,20,25,27H,7-12H2,1-3H3,(H,24,26)/t14?,15?,16?,20-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448238
(CHEMBL3120754)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC1C2CC3CC(C2)CC1C3 |TLB:18:19:21:25.23.24,THB:23:22:19:25.24.26,23:24:21.22.28:19,26:24:21:28.27.19,26:27:21:25.23.24,(61.35,-6.19,;61.35,-4.65,;60.01,-3.88,;58.68,-4.65,;60.01,-2.33,;61.34,-1.56,;62.68,-2.33,;62.68,-3.88,;64.02,-4.65,;63.25,-5.98,;64.79,-5.98,;65.35,-3.87,;66.69,-4.64,;67.46,-5.97,;66.28,-6.12,;68.02,-3.87,;69.35,-4.64,;69.36,-6.18,;70.69,-3.86,;71.95,-4.74,;71.97,-6.23,;70.78,-7.51,;72.28,-7.08,;73.68,-7.64,;74.69,-6.36,;73.3,-6.71,;74.69,-4.83,;73.3,-4.26,;72.26,-5.5,)| Show InChI InChI=1S/C22H31ClN2O3S/c1-13-18(23)5-4-6-19(13)29(27,28)25-22(2,3)12-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h4-6,14-17,21,25H,7-12H2,1-3H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 4 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50319665
((S)-2-((1S,2S,4R)-Bicyclo[2.2.1]heptan-2-ylamino)-...)Show SMILES CC(C)[C@]1(C)SC(N[C@H]2C[C@@H]3CC[C@H]2C3)=NC1=O |r,c:16| Show InChI InChI=1S/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448228
(CHEMBL3120821)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cc(F)cc(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.35,-34.25,;34.58,-32.91,;34.17,-34.39,;35.91,-32.14,;37.24,-32.91,;37.25,-34.45,;38.58,-32.14,;39.84,-33.01,;41.19,-32.53,;40.15,-33.77,;40.17,-35.35,;38.67,-35.78,;39.86,-34.5,;41.19,-34.98,;42.58,-34.63,;41.58,-35.91,;42.59,-33.1,;43.92,-35.4,;45.25,-34.63,;43.92,-36.94,;33.24,-32.15,;31.91,-32.92,;31.14,-34.25,;32.68,-34.25,;30.57,-32.15,;30.57,-30.6,;29.23,-29.84,;29.23,-28.3,;27.9,-30.61,;27.9,-32.15,;26.57,-32.92,;29.24,-32.92,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)17-6-15(23)5-16(24)7-17)11-18(28)26-19-13-3-12-4-14(19)10-22(8-12,9-13)20(25)29/h5-7,12-14,19,27H,3-4,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448229
(CHEMBL3120820)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(F)c1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(11.78,-31.4,;11.01,-30.07,;10.6,-31.55,;12.34,-29.3,;13.68,-30.06,;13.68,-31.6,;15.01,-29.29,;16.27,-30.17,;17.62,-29.68,;16.59,-30.92,;16.6,-32.51,;15.1,-32.94,;16.29,-31.65,;17.62,-32.14,;19.01,-31.79,;18.01,-33.06,;19.02,-30.25,;20.35,-32.56,;21.68,-31.79,;20.34,-34.1,;9.67,-29.3,;8.34,-30.07,;7.57,-31.41,;9.11,-31.4,;7.01,-29.3,;7,-27.75,;5.67,-26.99,;4.34,-27.76,;4.34,-29.3,;3,-30.07,;5.67,-30.07,;5.67,-31.61,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448231
(CHEMBL3120818)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1Cl |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(10.27,-32,;9.5,-30.67,;9.09,-32.15,;10.83,-29.9,;12.17,-30.67,;12.17,-32.21,;13.5,-29.9,;14.76,-30.77,;16.11,-30.29,;15.08,-31.53,;15.09,-33.11,;13.59,-33.54,;14.78,-32.26,;16.11,-32.74,;17.51,-32.39,;16.5,-33.67,;17.51,-30.86,;18.86,-33.13,;20.17,-32.33,;18.89,-34.67,;8.17,-29.9,;6.83,-30.68,;6.06,-32.01,;7.6,-32.01,;5.5,-29.91,;5.49,-28.36,;4.16,-27.59,;2.83,-28.36,;2.83,-29.91,;1.49,-30.68,;4.16,-30.68,;4.16,-32.22,)| Show InChI InChI=1S/C22H29Cl2N3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448232
(CHEMBL3120817)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(29.03,-26.58,;28.26,-25.25,;27.85,-26.73,;29.59,-24.48,;30.93,-25.25,;30.93,-26.79,;32.26,-24.47,;33.52,-25.35,;34.87,-24.87,;33.84,-26.11,;33.85,-27.69,;32.35,-28.12,;33.54,-26.84,;34.87,-27.32,;36.26,-26.97,;35.26,-28.25,;36.27,-25.44,;37.59,-27.75,;38.93,-26.98,;37.59,-29.29,;26.92,-24.48,;25.59,-25.25,;24.82,-26.59,;26.36,-26.59,;24.26,-24.49,;24.25,-22.94,;22.92,-22.17,;21.59,-22.94,;21.59,-24.49,;20.25,-25.26,;22.92,-25.26,;22.92,-26.8,)| Show InChI InChI=1S/C22H29ClFN3O4S/c1-21(2,27-32(30,31)16-5-3-4-15(23)18(16)24)11-17(28)26-19-13-6-12-7-14(19)10-22(8-12,9-13)20(25)29/h3-5,12-14,19,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448233
(CHEMBL3120816)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CC1 |TLB:16:17:19:23.21.22,THB:21:20:17:23.22.24,21:22:19.20.26:17,24:22:19:26.25.17,24:25:19:23.21.22,(5.53,-25.39,;5.53,-23.85,;4.19,-23.08,;2.86,-23.85,;4.2,-21.54,;5.53,-20.77,;6.86,-21.53,;6.87,-23.08,;8.2,-23.85,;7.43,-25.18,;8.97,-25.18,;9.53,-23.08,;10.87,-23.84,;12.2,-23.07,;13.54,-23.84,;13.54,-25.38,;14.87,-23.07,;16.13,-23.94,;16.15,-25.43,;14.96,-26.71,;16.46,-26.28,;17.87,-26.84,;18.88,-25.56,;17.48,-25.91,;18.88,-24.03,;17.48,-23.46,;16.45,-24.7,;10.1,-25.18,;11.64,-25.17,)| Show InChI InChI=1S/C22H29ClN2O3S/c1-13-18(23)3-2-4-19(13)29(27,28)25-22(5-6-22)12-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h2-4,14-17,21,25H,5-12H2,1H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448235
(CHEMBL3120758)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,29:26:23:21.20.19,(48.96,-12.34,;48.96,-10.8,;47.63,-10.03,;46.29,-10.8,;47.63,-8.49,;48.96,-7.71,;50.29,-8.48,;50.3,-10.03,;51.63,-10.8,;50.86,-12.13,;52.4,-12.13,;52.96,-10.02,;54.3,-10.79,;55.07,-12.13,;53.89,-12.27,;55.63,-10.02,;56.97,-10.79,;56.97,-12.33,;58.3,-10.02,;59.56,-10.89,;60.91,-10.41,;59.88,-11.65,;59.89,-13.23,;58.39,-13.66,;59.58,-12.38,;60.91,-12.86,;62.31,-12.51,;61.3,-13.79,;62.31,-10.98,;63.66,-13.24,;64.97,-12.44,;63.7,-14.78,)| Show InChI InChI=1S/C23H32ClN3O4S/c1-13-17(24)5-4-6-18(13)32(30,31)27-22(2,3)12-19(28)26-20-15-7-14-8-16(20)11-23(9-14,10-15)21(25)29/h4-6,14-16,20,27H,7-12H2,1-3H3,(H2,25,29)(H,26,28)/t14?,15?,16?,20-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448227
(CHEMBL3120822)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1c(F)cccc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(10.8,-38.9,;10.03,-37.57,;9.62,-39.05,;11.36,-36.8,;12.7,-37.57,;12.7,-39.11,;14.03,-36.8,;15.29,-37.67,;16.64,-37.19,;15.61,-38.43,;15.62,-40.01,;14.12,-40.44,;15.31,-39.16,;16.64,-39.64,;18.03,-39.29,;17.03,-40.57,;18.04,-37.76,;19.36,-40.07,;20.7,-39.3,;19.36,-41.61,;8.69,-36.8,;7.36,-37.58,;6.59,-38.91,;8.13,-38.91,;6.03,-36.81,;4.69,-37.58,;4.69,-39.12,;3.36,-36.81,;3.36,-35.26,;4.69,-34.49,;6.02,-35.26,;7.35,-34.48,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)19-15(23)4-3-5-16(19)24)11-17(28)26-18-13-6-12-7-14(18)10-22(8-12,9-13)20(25)29/h3-5,12-14,18,27H,6-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,18-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448223
(CHEMBL3120826)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccccc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(34.84,-49.23,;34.06,-47.89,;33.66,-49.38,;35.4,-47.12,;36.73,-47.89,;36.73,-49.43,;38.06,-47.12,;39.33,-48,;40.67,-47.51,;39.64,-48.75,;39.66,-50.34,;38.16,-50.76,;39.35,-49.48,;40.68,-49.96,;42.07,-49.61,;41.06,-50.89,;42.07,-48.08,;43.41,-50.36,;44.74,-49.57,;43.44,-51.9,;32.73,-47.13,;31.4,-47.9,;30.63,-49.23,;32.17,-49.23,;30.06,-47.13,;30.06,-45.58,;28.72,-44.82,;27.39,-45.59,;27.39,-47.13,;28.72,-47.9,;28.72,-49.44,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-6-4-3-5-16(17)23)12-18(27)25-19-14-7-13-8-15(19)11-22(9-13,10-14)20(24)28/h3-6,13-15,19,26H,7-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448230
(CHEMBL3120819)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)cc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.35,-34.25,;34.58,-32.91,;34.17,-34.39,;35.91,-32.14,;37.24,-32.91,;37.25,-34.45,;38.58,-32.14,;39.84,-33.01,;41.19,-32.53,;40.15,-33.77,;40.17,-35.35,;38.67,-35.78,;39.86,-34.5,;41.19,-34.98,;42.58,-34.63,;41.58,-35.91,;42.59,-33.1,;43.92,-35.4,;45.25,-34.63,;43.92,-36.94,;33.24,-32.15,;31.91,-32.92,;31.14,-34.25,;32.68,-34.25,;30.57,-32.15,;30.57,-30.6,;29.23,-29.84,;27.9,-30.61,;26.57,-29.84,;27.9,-32.15,;29.24,-32.92,;29.24,-34.46,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)17-4-3-15(23)7-16(17)24)11-18(28)26-19-13-5-12-6-14(19)10-22(8-12,9-13)20(25)29/h3-4,7,12-14,19,27H,5-6,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 22 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448221
(CHEMBL3120828)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)cc1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(16.74,-56.49,;15.96,-55.16,;15.56,-56.64,;17.3,-54.38,;18.63,-55.15,;18.63,-56.69,;19.96,-54.38,;21.23,-55.26,;22.57,-54.77,;21.54,-56.01,;21.55,-57.6,;20.05,-58.02,;21.24,-56.74,;22.58,-57.22,;23.97,-56.87,;22.96,-58.15,;23.97,-55.34,;25.29,-57.66,;26.63,-56.9,;25.28,-59.2,;14.63,-54.39,;13.3,-55.16,;12.53,-56.49,;14.07,-56.49,;11.96,-54.39,;10.62,-55.16,;9.29,-54.39,;9.29,-52.85,;7.96,-52.08,;10.62,-52.08,;11.96,-52.84,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-5-3-16(23)4-6-17)12-18(27)25-19-14-7-13-8-15(19)11-22(9-13,10-14)20(24)28/h3-6,13-15,19,26H,7-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 24 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448225
(CHEMBL3120824)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1c(F)cc(F)cc1F |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.27,-35.23,;34.5,-33.9,;34.09,-35.38,;35.83,-33.13,;37.16,-33.9,;37.17,-35.44,;38.5,-33.12,;39.76,-34,;41.11,-33.51,;40.07,-34.76,;40.09,-36.34,;38.59,-36.77,;39.78,-35.49,;41.11,-35.97,;42.5,-35.62,;41.5,-36.9,;42.51,-34.09,;43.83,-36.4,;45.17,-35.64,;43.81,-37.94,;33.16,-33.13,;31.83,-33.9,;31.06,-35.24,;32.6,-35.24,;30.49,-33.14,;29.16,-33.91,;29.16,-35.45,;27.82,-33.14,;27.83,-31.59,;26.49,-30.82,;29.15,-30.82,;30.49,-31.59,;31.82,-30.81,)| Show InChI InChI=1S/C22H28F3N3O4S/c1-21(2,28-33(31,32)19-15(24)5-14(23)6-16(19)25)10-17(29)27-18-12-3-11-4-13(18)9-22(7-11,8-12)20(26)30/h5-6,11-13,18,28H,3-4,7-10H2,1-2H3,(H2,26,30)(H,27,29)/t11?,12?,13?,18-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448222
(CHEMBL3120827)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(31.67,-49.6,;30.9,-48.27,;30.49,-49.75,;32.23,-47.5,;33.56,-48.27,;33.57,-49.81,;34.9,-47.5,;36.16,-48.37,;37.51,-47.89,;36.47,-49.13,;36.49,-50.71,;34.99,-51.14,;36.18,-49.86,;37.51,-50.34,;38.9,-49.99,;37.9,-51.27,;38.9,-48.46,;40.27,-50.69,;41.56,-49.85,;40.35,-52.23,;29.56,-47.5,;28.23,-48.28,;27.46,-49.61,;29,-49.61,;26.89,-47.51,;26.89,-45.96,;25.55,-45.19,;24.22,-45.97,;24.22,-47.51,;22.89,-48.28,;25.56,-48.28,)| Show InChI InChI=1S/C22H30FN3O4S/c1-21(2,26-31(29,30)17-5-3-4-16(23)8-17)12-18(27)25-19-14-6-13-7-15(19)11-22(9-13,10-14)20(24)28/h3-5,8,13-15,19,26H,6-7,9-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448224
(CHEMBL3120825)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cccc(Cl)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(11.44,-47.23,;10.67,-45.9,;10.26,-47.38,;12,-45.12,;13.33,-45.89,;13.34,-47.43,;14.67,-45.12,;15.93,-46,;17.28,-45.51,;16.25,-46.75,;16.26,-48.34,;14.76,-48.76,;15.95,-47.48,;17.28,-47.96,;18.67,-47.61,;17.67,-48.89,;18.68,-46.08,;20.01,-48.37,;21.34,-47.59,;20.03,-49.91,;9.33,-45.13,;8,-45.9,;7.23,-47.23,;8.77,-47.23,;6.66,-45.13,;6.66,-43.58,;5.32,-42.82,;4,-43.59,;3.99,-45.13,;2.66,-45.9,;5.33,-45.9,)| Show InChI InChI=1S/C22H30ClN3O4S/c1-21(2,26-31(29,30)17-5-3-4-16(23)8-17)12-18(27)25-19-14-6-13-7-15(19)11-22(9-13,10-14)20(24)28/h3-5,8,13-15,19,26H,6-7,9-12H2,1-2H3,(H2,24,28)(H,25,27)/t13?,14?,15?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 46 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448240
(CHEMBL3120761)Show SMILES C[C@H](CC(=O)NC1C2CC3CC(C2)CC1C3)NS(=O)(=O)c1cccc(Cl)c1C |r,wU:1.0,TLB:5:6:8:12.10.11,THB:10:9:6:12.11.13,10:11:8.9.15:6,13:11:8:15.14.6,13:14:8:12.10.11,(67.38,-20.97,;67.39,-19.43,;68.72,-18.66,;70.06,-19.43,;70.06,-20.97,;71.39,-18.66,;72.66,-19.54,;72.67,-21.02,;71.48,-22.3,;72.98,-21.87,;74.39,-22.43,;75.4,-21.15,;74,-21.5,;75.4,-19.62,;74,-19.05,;72.97,-20.29,;66.06,-18.67,;64.72,-19.44,;63.96,-20.77,;65.5,-20.77,;63.39,-18.67,;63.38,-17.12,;62.05,-16.36,;60.72,-17.13,;60.72,-18.67,;59.38,-19.44,;62.05,-19.44,;62.05,-20.98,)| Show InChI InChI=1S/C21H29ClN2O3S/c1-12(24-28(26,27)19-5-3-4-18(22)13(19)2)6-20(25)23-21-16-8-14-7-15(10-16)11-17(21)9-14/h3-5,12,14-17,21,24H,6-11H2,1-2H3,(H,23,25)/t12-,14?,15?,16?,17?,21?/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448234
(CHEMBL3120759)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)S(C)(=O)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:29:26:23:21.20.19,27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,(2.64,-18.38,;2.64,-16.84,;1.31,-16.07,;-.04,-16.84,;1.31,-14.53,;2.64,-13.76,;3.98,-14.52,;3.98,-16.07,;5.32,-16.84,;4.55,-18.18,;6.09,-18.17,;6.65,-16.07,;7.98,-16.84,;8.76,-18.17,;7.58,-18.32,;9.32,-16.06,;10.65,-16.83,;10.65,-18.37,;11.98,-16.06,;13.25,-16.94,;14.59,-16.45,;13.56,-17.69,;13.58,-19.28,;12.08,-19.71,;13.27,-18.42,;14.6,-18.91,;15.99,-18.56,;14.98,-19.83,;15.99,-17.02,;17.35,-19.27,;17.41,-20.81,;18.89,-19.21,;18.07,-17.91,)| Show InChI InChI=1S/C23H33ClN2O5S2/c1-14-18(24)6-5-7-19(14)33(30,31)26-22(2,3)13-20(27)25-21-16-8-15-9-17(21)12-23(10-15,11-16)32(4,28)29/h5-7,15-17,21,26H,8-13H2,1-4H3,(H,25,27)/t15?,16?,17?,21-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 54 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448236
(CHEMBL3120756)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(O)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,29:26:23:21.20.19,(.71,-11.2,;.71,-9.66,;-.63,-8.89,;-1.97,-9.66,;-.64,-7.35,;.7,-6.58,;2.04,-7.34,;2.04,-8.89,;3.38,-9.66,;2.61,-11,;4.15,-10.99,;4.71,-8.89,;6.05,-9.66,;6.82,-10.99,;5.64,-11.14,;7.38,-8.88,;8.71,-9.65,;8.72,-11.19,;10.05,-8.88,;11.31,-9.76,;12.66,-9.27,;11.62,-10.51,;11.64,-12.1,;10.14,-12.53,;11.33,-11.24,;12.66,-11.73,;14.05,-11.37,;13.05,-12.65,;14.06,-9.84,;15.39,-12.14,;16.72,-11.36,;15.39,-13.68,)| Show InChI InChI=1S/C23H31ClN2O5S/c1-13-17(24)5-4-6-18(13)32(30,31)26-22(2,3)12-19(27)25-20-15-7-14-8-16(20)11-23(9-14,10-15)21(28)29/h4-6,14-16,20,26H,7-12H2,1-3H3,(H,25,27)(H,28,29)/t14?,15?,16?,20-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 57 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448237
(CHEMBL3120755)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](O)(C3)C2 |r,wU:19.19,wD:26.28,TLB:29:26:23:21.20.19,18:19:23:25.28.26,27:26:23:21.20.19,27:26:23.22.21:19,THB:28:22:19:25.26.29,28:26:23.22.21:19,29:20:23:25.28.26,(61.35,-6.19,;61.35,-4.65,;60.01,-3.88,;58.68,-4.65,;60.01,-2.33,;61.34,-1.56,;62.68,-2.33,;62.68,-3.88,;64.02,-4.65,;63.25,-5.98,;64.79,-5.98,;65.35,-3.87,;66.69,-4.64,;67.46,-5.97,;66.28,-6.12,;68.02,-3.87,;69.35,-4.64,;69.36,-6.18,;70.69,-3.86,;71.95,-4.74,;73.3,-4.26,;72.26,-5.5,;72.28,-7.08,;70.78,-7.51,;71.97,-6.23,;73.3,-6.71,;74.69,-6.36,;76.23,-6.29,;73.68,-7.64,;74.69,-4.83,)| Show InChI InChI=1S/C22H31ClN2O4S/c1-13-17(23)5-4-6-18(13)30(28,29)25-21(2,3)12-19(26)24-20-15-7-14-8-16(20)11-22(27,9-14)10-15/h4-6,14-16,20,25,27H,7-12H2,1-3H3,(H,24,26)/t14?,15?,16?,20-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448239
(CHEMBL3120753)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC12CC3CC(CC(C3)C1)C2 |THB:24:23:20:26.25.27,24:25:22.23.28:20,27:25:22:28.19.20,27:19:22:26.24.25,18:19:22:26.24.25| Show InChI InChI=1S/C22H31ClN2O3S/c1-14-18(23)5-4-6-19(14)29(27,28)25-21(2,3)13-20(26)24-22-10-15-7-16(11-22)9-17(8-15)12-22/h4-6,15-17,25H,7-13H2,1-3H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 80 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448241
(CHEMBL3120760)Show SMILES C[C@@H](CC(=O)NC1C2CC3CC(C2)CC1C3)NS(=O)(=O)c1cccc(Cl)c1C |r,wD:1.0,TLB:5:6:8:12.10.11,THB:10:9:6:12.11.13,10:11:8.9.15:6,13:11:8:15.14.6,13:14:8:12.10.11,(48.85,-20.13,;48.86,-18.59,;50.2,-17.82,;51.53,-18.59,;51.53,-20.13,;52.86,-17.82,;54.13,-18.7,;54.14,-20.18,;52.95,-21.46,;54.45,-21.03,;55.86,-21.59,;56.87,-20.31,;55.48,-20.66,;56.87,-18.78,;55.47,-18.21,;54.44,-19.45,;47.53,-17.83,;46.2,-18.6,;45.43,-19.93,;46.97,-19.93,;44.86,-17.83,;44.86,-16.28,;43.52,-15.52,;42.19,-16.29,;42.19,-17.83,;40.85,-18.6,;43.52,-18.6,;43.52,-20.14,)| Show InChI InChI=1S/C21H29ClN2O3S/c1-12(24-28(26,27)19-5-3-4-18(22)13(19)2)6-20(25)23-21-16-8-14-7-15(10-16)11-17(21)9-14/h3-5,12,14-17,21,24H,6-11H2,1-2H3,(H,23,25)/t12-,14?,15?,16?,17?,21?/m0/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 89 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448233
(CHEMBL3120816)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC1(CC(=O)NC2C3CC4CC(C3)CC2C4)CC1 |TLB:16:17:19:23.21.22,THB:21:20:17:23.22.24,21:22:19.20.26:17,24:22:19:26.25.17,24:25:19:23.21.22,(5.53,-25.39,;5.53,-23.85,;4.19,-23.08,;2.86,-23.85,;4.2,-21.54,;5.53,-20.77,;6.86,-21.53,;6.87,-23.08,;8.2,-23.85,;7.43,-25.18,;8.97,-25.18,;9.53,-23.08,;10.87,-23.84,;12.2,-23.07,;13.54,-23.84,;13.54,-25.38,;14.87,-23.07,;16.13,-23.94,;16.15,-25.43,;14.96,-26.71,;16.46,-26.28,;17.87,-26.84,;18.88,-25.56,;17.48,-25.91,;18.88,-24.03,;17.48,-23.46,;16.45,-24.7,;10.1,-25.18,;11.64,-25.17,)| Show InChI InChI=1S/C22H29ClN2O3S/c1-13-18(23)3-2-4-19(13)29(27,28)25-22(5-6-22)12-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h2-4,14-17,21,25H,5-12H2,1H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 94 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448228
(CHEMBL3120821)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1cc(F)cc(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(35.35,-34.25,;34.58,-32.91,;34.17,-34.39,;35.91,-32.14,;37.24,-32.91,;37.25,-34.45,;38.58,-32.14,;39.84,-33.01,;41.19,-32.53,;40.15,-33.77,;40.17,-35.35,;38.67,-35.78,;39.86,-34.5,;41.19,-34.98,;42.58,-34.63,;41.58,-35.91,;42.59,-33.1,;43.92,-35.4,;45.25,-34.63,;43.92,-36.94,;33.24,-32.15,;31.91,-32.92,;31.14,-34.25,;32.68,-34.25,;30.57,-32.15,;30.57,-30.6,;29.23,-29.84,;29.23,-28.3,;27.9,-30.61,;27.9,-32.15,;26.57,-32.92,;29.24,-32.92,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)17-6-15(23)5-16(24)7-17)11-18(28)26-19-13-3-12-4-14(19)10-22(8-12,9-13)20(25)29/h5-7,12-14,19,27H,3-4,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 99 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448238
(CHEMBL3120754)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC1C2CC3CC(C2)CC1C3 |TLB:18:19:21:25.23.24,THB:23:22:19:25.24.26,23:24:21.22.28:19,26:24:21:28.27.19,26:27:21:25.23.24,(61.35,-6.19,;61.35,-4.65,;60.01,-3.88,;58.68,-4.65,;60.01,-2.33,;61.34,-1.56,;62.68,-2.33,;62.68,-3.88,;64.02,-4.65,;63.25,-5.98,;64.79,-5.98,;65.35,-3.87,;66.69,-4.64,;67.46,-5.97,;66.28,-6.12,;68.02,-3.87,;69.35,-4.64,;69.36,-6.18,;70.69,-3.86,;71.95,-4.74,;71.97,-6.23,;70.78,-7.51,;72.28,-7.08,;73.68,-7.64,;74.69,-6.36,;73.3,-6.71,;74.69,-4.83,;73.3,-4.26,;72.26,-5.5,)| Show InChI InChI=1S/C22H31ClN2O3S/c1-13-18(23)5-4-6-19(13)29(27,28)25-22(2,3)12-20(26)24-21-16-8-14-7-15(10-16)11-17(21)9-14/h4-6,14-17,21,25H,7-12H2,1-3H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 113 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448243
(CHEMBL3120752)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC1CCCCCC1 Show InChI InChI=1S/C19H29ClN2O3S/c1-14-16(20)11-8-12-17(14)26(24,25)22-19(2,3)13-18(23)21-15-9-6-4-5-7-10-15/h8,11-12,15,22H,4-7,9-10,13H2,1-3H3,(H,21,23) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 190 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448226
(CHEMBL3120823)Show SMILES CC(C)(CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(N)=O)NS(=O)(=O)c1ccc(F)c(F)c1 |r,wU:7.6,wD:14.19,TLB:16:14:11:9.8.7,6:7:11:13.15.14,THB:15:10:7:13.14.16,15:14:11.10.9:7,16:8:11:13.15.14,17:14:11:9.8.7,(31.84,-41.57,;31.07,-40.23,;30.66,-41.71,;32.4,-39.46,;33.74,-40.23,;33.74,-41.77,;35.07,-39.46,;36.33,-40.33,;37.68,-39.85,;36.65,-41.09,;36.66,-42.67,;35.16,-43.1,;36.35,-41.82,;37.68,-42.3,;39.08,-41.95,;38.07,-43.23,;39.08,-40.42,;40.44,-42.66,;41.74,-41.83,;40.51,-44.2,;29.73,-39.47,;28.4,-40.24,;27.63,-41.57,;29.17,-41.57,;27.07,-39.47,;27.06,-37.92,;25.73,-37.16,;24.4,-37.93,;23.06,-37.16,;24.4,-39.47,;23.06,-40.24,;25.73,-40.24,)| Show InChI InChI=1S/C22H29F2N3O4S/c1-21(2,27-32(30,31)15-3-4-16(23)17(24)7-15)11-18(28)26-19-13-5-12-6-14(19)10-22(8-12,9-13)20(25)29/h3-4,7,12-14,19,27H,5-6,8-11H2,1-2H3,(H2,25,29)(H,26,28)/t12?,13?,14?,19-,22- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 196 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448244
(CHEMBL3120751)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC1CCCCC1 Show InChI InChI=1S/C18H27ClN2O3S/c1-13-15(19)10-7-11-16(13)25(23,24)21-18(2,3)12-17(22)20-14-8-5-4-6-9-14/h7,10-11,14,21H,4-6,8-9,12H2,1-3H3,(H,20,22) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 390 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50319665
((S)-2-((1S,2S,4R)-Bicyclo[2.2.1]heptan-2-ylamino)-...)Show SMILES CC(C)[C@]1(C)SC(N[C@H]2C[C@@H]3CC[C@H]2C3)=NC1=O |r,c:16| Show InChI InChI=1S/C14H22N2OS/c1-8(2)14(3)12(17)16-13(18-14)15-11-7-9-4-5-10(11)6-9/h8-11H,4-7H2,1-3H3,(H,15,16,17)/t9-,10+,11+,14+/m1/s1 | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| Purchase
CHEMBL MCE PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | 470 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448239
(CHEMBL3120753)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)NC12CC3CC(CC(C3)C1)C2 |THB:24:23:20:26.25.27,24:25:22.23.28:20,27:25:22:28.19.20,27:19:22:26.24.25,18:19:22:26.24.25| Show InChI InChI=1S/C22H31ClN2O3S/c1-14-18(23)5-4-6-19(14)29(27,28)25-21(2,3)13-20(26)24-22-10-15-7-16(11-22)9-17(8-15)12-22/h4-6,15-17,25H,7-13H2,1-3H3,(H,24,26) | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 640 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448234
(CHEMBL3120759)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)S(C)(=O)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:29:26:23:21.20.19,27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,(2.64,-18.38,;2.64,-16.84,;1.31,-16.07,;-.04,-16.84,;1.31,-14.53,;2.64,-13.76,;3.98,-14.52,;3.98,-16.07,;5.32,-16.84,;4.55,-18.18,;6.09,-18.17,;6.65,-16.07,;7.98,-16.84,;8.76,-18.17,;7.58,-18.32,;9.32,-16.06,;10.65,-16.83,;10.65,-18.37,;11.98,-16.06,;13.25,-16.94,;14.59,-16.45,;13.56,-17.69,;13.58,-19.28,;12.08,-19.71,;13.27,-18.42,;14.6,-18.91,;15.99,-18.56,;14.98,-19.83,;15.99,-17.02,;17.35,-19.27,;17.41,-20.81,;18.89,-19.21,;18.07,-17.91,)| Show InChI InChI=1S/C23H33ClN2O5S2/c1-14-18(24)6-5-7-19(14)33(30,31)26-22(2,3)13-20(27)25-21-16-8-15-9-17(21)12-23(10-15,11-16)32(4,28)29/h5-7,15-17,21,26H,8-13H2,1-4H3,(H,25,27)/t15?,16?,17?,21-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Mus musculus (mouse)) | BDBM50448236
(CHEMBL3120756)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@](C3)(C2)C(O)=O |r,wU:19.19,wD:26.32,TLB:28:26:23:21.20.19,18:19:23:25.27.26,THB:27:22:19:25.26.28,27:26:23.22.21:19,28:20:23:25.27.26,29:26:23:21.20.19,(.71,-11.2,;.71,-9.66,;-.63,-8.89,;-1.97,-9.66,;-.64,-7.35,;.7,-6.58,;2.04,-7.34,;2.04,-8.89,;3.38,-9.66,;2.61,-11,;4.15,-10.99,;4.71,-8.89,;6.05,-9.66,;6.82,-10.99,;5.64,-11.14,;7.38,-8.88,;8.71,-9.65,;8.72,-11.19,;10.05,-8.88,;11.31,-9.76,;12.66,-9.27,;11.62,-10.51,;11.64,-12.1,;10.14,-12.53,;11.33,-11.24,;12.66,-11.73,;14.05,-11.37,;13.05,-12.65,;14.06,-9.84,;15.39,-12.14,;16.72,-11.36,;15.39,-13.68,)| Show InChI InChI=1S/C23H31ClN2O5S/c1-13-17(24)5-4-6-18(13)32(30,31)26-22(2,3)12-19(27)25-20-15-7-14-8-16(20)11-23(9-14,10-15)21(28)29/h4-6,14-16,20,26H,7-12H2,1-3H3,(H,25,27)(H,28,29)/t14?,15?,16?,20-,23- | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in mouse liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |
11-beta-hydroxysteroid dehydrogenase 1
(Homo sapiens (Human)) | BDBM50448242
(CHEMBL3120757)Show SMILES Cc1c(Cl)cccc1S(=O)(=O)NC(C)(C)CC(=O)N[C@H]1C2CC3CC1C[C@@](C3)(C2)C(N)=O |r,wD:19.19,26.32,TLB:18:19:21:28.27.26,29:26:21:23.24.19,THB:27:22:19:28.26.25,27:26:21.22.23:19,25:26:21:23.24.19,25:24:21:28.27.26,(22.52,-11.86,;22.52,-10.32,;21.19,-9.55,;19.86,-10.32,;21.19,-8,;22.52,-7.23,;23.86,-8,;23.86,-9.55,;25.2,-10.31,;24.43,-11.65,;25.97,-11.65,;26.53,-9.54,;27.86,-10.31,;28.64,-11.64,;27.46,-11.79,;29.2,-9.54,;30.53,-10.31,;30.53,-11.85,;31.86,-9.53,;33.13,-10.41,;33.15,-11.9,;31.96,-13.18,;33.45,-12.75,;33.44,-11.17,;34.47,-9.93,;35.87,-10.5,;35.87,-12.03,;34.86,-13.31,;34.48,-12.38,;37.21,-12.78,;38.54,-11.99,;37.23,-14.32,)| Show InChI InChI=1S/C23H32ClN3O4S/c1-13-17(24)5-4-6-18(13)32(30,31)27-22(2,3)12-19(28)26-20-15-7-14-8-16(20)11-23(9-14,10-15)21(25)29/h4-6,14-16,20,27H,7-12H2,1-3H3,(H2,25,29)(H,26,28)/t14?,15?,16?,20-,23+ | PDB MMDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | >1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Yonsei University
Curated by ChEMBL
| Assay Description Inhibition of 11beta-HSD1 in human liver microsomes using cortisone as substrate after 2 hrs by HTRF assay |
Bioorg Med Chem Lett 24: 1421-5 (2014)
Article DOI: 10.1016/j.bmcl.2014.01.017 BindingDB Entry DOI: 10.7270/Q2BG2QG8 |
More data for this Ligand-Target Pair | |