Found 5 hits Enz. Inhib. hit(s) with Target = 'Glucocorticoid receptor' and Ligand = 'BDBM50338738' 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 |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50338738
((3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,...)Show SMILES C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)| Show InChI InChI=1S/C27H24ClF2N3O2/c1-14-21-20(33-27(2,3)25(14)35-26(34)32-15-8-5-4-6-9-15)12-19(29)22(23(21)30)17-11-7-10-16-18(28)13-31-24(16)17/h4-14,25,31,33H,1-3H3,(H,32,34)/t14-,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 7.60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Ligand Pharmaceuticals
Curated by ChEMBL
| Assay Description Displacement of radiolabeled dexamethasone from GR |
Bioorg Med Chem Lett 21: 1658-62 (2011)
Article DOI: 10.1016/j.bmcl.2011.01.106 BindingDB Entry DOI: 10.7270/Q2VQ32Z4 |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50338738
((3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,...)Show SMILES C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)| Show InChI InChI=1S/C27H24ClF2N3O2/c1-14-21-20(33-27(2,3)25(14)35-26(34)32-15-8-5-4-6-9-15)12-19(29)22(23(21)30)17-11-7-10-16-18(28)13-31-24(16)17/h4-14,25,31,33H,1-3H3,(H,32,34)/t14-,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 9.10 | n/a | n/a | n/a | n/a | n/a | n/a |
Ligand Pharmaceuticals
Curated by ChEMBL
| Assay Description Transrepression activity at GR expressed in IL-1beta- and TNFalpha-stimulated HepG2 cells assessed as inhibition of NFKB- or AP-1 mediated E-selectin... |
Bioorg Med Chem Lett 21: 1658-62 (2011)
Article DOI: 10.1016/j.bmcl.2011.01.106 BindingDB Entry DOI: 10.7270/Q2VQ32Z4 |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50338738
((3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,...)Show SMILES C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)| Show InChI InChI=1S/C27H24ClF2N3O2/c1-14-21-20(33-27(2,3)25(14)35-26(34)32-15-8-5-4-6-9-15)12-19(29)22(23(21)30)17-11-7-10-16-18(28)13-31-24(16)17/h4-14,25,31,33H,1-3H3,(H,32,34)/t14-,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/a |
Ligand Pharmaceuticals
Curated by ChEMBL
| Assay Description Transrepression activity at GR expressed in NHDF cells assessed as IL-1beta-mediated IL-6 transcription by ELISA |
Bioorg Med Chem Lett 21: 1658-62 (2011)
Article DOI: 10.1016/j.bmcl.2011.01.106 BindingDB Entry DOI: 10.7270/Q2VQ32Z4 |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50338738
((3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,...)Show SMILES C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)| Show InChI InChI=1S/C27H24ClF2N3O2/c1-14-21-20(33-27(2,3)25(14)35-26(34)32-15-8-5-4-6-9-15)12-19(29)22(23(21)30)17-11-7-10-16-18(28)13-31-24(16)17/h4-14,25,31,33H,1-3H3,(H,32,34)/t14-,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 379 | n/a | n/a | n/a | n/a |
Ligand Pharmaceuticals
Curated by ChEMBL
| Assay Description Agonist activity at GR expressed in rat H4IIEC3 cells assessed as induction of PEPCK transactivation by luciferase reporter gene assay |
Bioorg Med Chem Lett 21: 1658-62 (2011)
Article DOI: 10.1016/j.bmcl.2011.01.106 BindingDB Entry DOI: 10.7270/Q2VQ32Z4 |
More data for this Ligand-Target Pair | |
Glucocorticoid receptor
(Homo sapiens (Human)) | BDBM50338738
((3R,4S)-6-(3-chloro-1H-indol-7-yl)-5,7-difluoro-2,...)Show SMILES C[C@@H]1[C@@H](OC(=O)Nc2ccccc2)C(C)(C)Nc2cc(F)c(c(F)c12)-c1cccc2c(Cl)c[nH]c12 |r,wU:2.2,wD:1.0,(1.33,-45.61,;1.33,-47.15,;2.67,-47.93,;4.01,-47.16,;5.34,-47.94,;5.34,-49.48,;6.68,-47.17,;8.01,-47.94,;8,-49.48,;9.33,-50.26,;10.67,-49.49,;10.67,-47.94,;9.34,-47.18,;2.67,-49.48,;4.21,-49.47,;2.66,-51.01,;1.33,-50.24,;-0,-49.47,;-1.33,-50.25,;-2.66,-49.48,;-4,-50.25,;-2.66,-47.93,;-1.33,-47.16,;-1.34,-45.62,;0,-47.93,;-4,-47.16,;-3.99,-45.62,;-5.32,-44.85,;-6.66,-45.62,;-6.65,-47.18,;-7.78,-48.22,;-9.29,-47.91,;-7.14,-49.61,;-5.62,-49.43,;-5.32,-47.93,)| Show InChI InChI=1S/C27H24ClF2N3O2/c1-14-21-20(33-27(2,3)25(14)35-26(34)32-15-8-5-4-6-9-15)12-19(29)22(23(21)30)17-11-7-10-16-18(28)13-31-24(16)17/h4-14,25,31,33H,1-3H3,(H,32,34)/t14-,25+/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 7.60 | n/a | n/a | n/a | n/a |
Ligand Pharmaceuticals
Curated by ChEMBL
| Assay Description Agonist activity at GR expressed in african green monkey CV1 cells transfected with luciferase gene linked to MMTV promoter assessed as induction of ... |
Bioorg Med Chem Lett 21: 1658-62 (2011)
Article DOI: 10.1016/j.bmcl.2011.01.106 BindingDB Entry DOI: 10.7270/Q2VQ32Z4 |
More data for this Ligand-Target Pair | |