Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Glucocorticoid receptor' and Ligand = 'BDBM50440484'   

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))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity to glucocorticoid receptor-LBD (unknown origin) by fluorescence polarization assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Binding affinity to glucocorticoid receptor-LBD (unknown origin) by fluorescence polarization assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	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	>1.00E+4	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transactivation of GR-LBD expressed in human HeLa cells co-expressing GAL4-DBD by luciferase reporter gene assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	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	>2.50E+3	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression of glucocorticoid receptor in human A549 cells assessed as inhibition of PMA-induced AP-1 activity by luciferase reporter gene assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	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	60	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transrepression of glucocorticoid receptor in human A549 cells assessed as inhibition of PMA-induced AP-1 activity by luciferase reporter gene assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50440484 (CHEMBL2426139) Show SMILES CC(C)(C(c1ccccc1)c1ccn2c(ncc2c1)-c1ccccc1)C(=O)Nc1nccs1 Show InChI InChI=1S/C27H24N4OS/c1-27(2,25(32)30-26-28-14-16-33-26)23(19-9-5-3-6-10-19)21-13-15-31-22(17-21)18-29-24(31)20-11-7-4-8-12-20/h3-18,23H,1-2H3,(H,28,30,32)	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	360	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Transactivation of GR-LBD expressed in human HeLa cells co-expressing GAL4-DBD by luciferase reporter gene assay				Bioorg Med Chem Lett 23: 5571-4 (2013) Article DOI: 10.1016/j.bmcl.2013.08.049 BindingDB Entry DOI: 10.7270/Q2QC04Z4
					More data for this Ligand-Target Pair