BDBM50014543 CHEMBL3261424

SMILES: C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)cc1)NS(=O)(=O)c1c(C)nn(C2CCCC2)c1C

InChI Key: InChIKey=MYWYNENZGUSROH-KRWDZBQOSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50014543   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50014543 (CHEMBL3261424) Show SMILES C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)cc1)NS(=O)(=O)c1c(C)nn(C2CCCC2)c1C |r| Show InChI InChI=1S/C26H31FN6O2S/c1-17(31-36(34,35)26-18(2)30-32(19(26)3)21-7-4-5-8-21)15-28-24-9-6-10-25-23(24)16-29-33(25)22-13-11-20(27)12-14-22/h6,9-14,16-17,21,28,31H,4-5,7-8,15H2,1-3H3/t17-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Binding affinity to human glucocorticoid receptor by fluorescence polarization assay				Bioorg Med Chem Lett 24: 2571-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.070 BindingDB Entry DOI: 10.7270/Q2JQ12J6
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50014543 (CHEMBL3261424) Show SMILES C[C@@H](CNc1cccc2n(ncc12)-c1ccc(F)cc1)NS(=O)(=O)c1c(C)nn(C2CCCC2)c1C |r| Show InChI InChI=1S/C26H31FN6O2S/c1-17(31-36(34,35)26-18(2)30-32(19(26)3)21-7-4-5-8-21)15-28-24-9-6-10-25-23(24)16-29-33(25)22-13-11-20(27)12-14-22/h6,9-14,16-17,21,28,31H,4-5,7-8,15H2,1-3H3/t17-/m0/s1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.70	n/a	n/a	n/a	n/a	n/a	n/a
AstraZeneca Curated by ChEMBL					Assay Description Agonist activity at glucocorticoid receptor in human Chago K1 cells assessed as gene transrepression by Lac-Z reporter gene assay				Bioorg Med Chem Lett 24: 2571-7 (2014) Article DOI: 10.1016/j.bmcl.2014.03.070 BindingDB Entry DOI: 10.7270/Q2JQ12J6
					More data for this Ligand-Target Pair