BDBM50081102 CHEMBL3421878

SMILES: [H][C@]12CCc3cc(O)ccc3[C@]1(CC)C[C@@](C)(O)[C@@](O)(C2)c1ccncc1

InChI Key: InChIKey=QFASAOKHBCPVQE-BRKWEVRTSA-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 = 50081102   

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))	BDBM50081102 (CHEMBL3421878) Show SMILES [H][C@]12CCc3cc(O)ccc3[C@]1(CC)C[C@@](C)(O)[C@@](O)(C2)c1ccncc1 |r| Show InChI InChI=1S/C22H27NO3/c1-3-21-14-20(2,25)22(26,16-8-10-23-11-9-16)13-17(21)5-4-15-12-18(24)6-7-19(15)21/h6-12,17,24-26H,3-5,13-14H2,1-2H3/t17-,20-,21-,22-/m1/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	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Transrepression activity at glucocorticoid receptor in human SW1353 cells assessed as repression of IL-1-induced MMP-13 production after 24 hrs by EL...				J Med Chem 58: 2658-77 (2015) Article DOI: 10.1021/jm501601b BindingDB Entry DOI: 10.7270/Q2GM891C
					More data for this Ligand-Target Pair
Glucocorticoid receptor (Homo sapiens (Human))	BDBM50081102 (CHEMBL3421878) Show SMILES [H][C@]12CCc3cc(O)ccc3[C@]1(CC)C[C@@](C)(O)[C@@](O)(C2)c1ccncc1 |r| Show InChI InChI=1S/C22H27NO3/c1-3-21-14-20(2,25)22(26,16-8-10-23-11-9-16)13-17(21)5-4-15-12-18(24)6-7-19(15)21/h6-12,17,24-26H,3-5,13-14H2,1-2H3/t17-,20-,21-,22-/m1/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	9.10	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Binding affinity to human GR				J Med Chem 58: 2658-77 (2015) Article DOI: 10.1021/jm501601b BindingDB Entry DOI: 10.7270/Q2GM891C
					More data for this Ligand-Target Pair