BDBM50145432 CHEMBL3764563

SMILES: COc1ccc(cc1)S(=O)(=O)NCc1cn(C[C@H]2CC=C(C(C)C)[C@@]22CCC(=O)C=C2)nn1

InChI Key: InChIKey=FPEBEYJKVPVBKT-KOSHJBKYSA-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 = 50145432   

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
11-beta-hydroxysteroid dehydrogenase 2 (Homo sapiens (Human))	BDBM50145432 (CHEMBL3764563) Show SMILES COc1ccc(cc1)S(=O)(=O)NCc1cn(C[C@H]2CC=C(C(C)C)[C@@]22CCC(=O)C=C2)nn1 |r,c:31,t:20| Show InChI InChI=1S/C24H30N4O4S/c1-17(2)23-9-4-18(24(23)12-10-20(29)11-13-24)15-28-16-19(26-27-28)14-25-33(30,31)22-7-5-21(32-3)6-8-22/h5-10,12,16-18,25H,4,11,13-15H2,1-3H3/t18-,24+/m1/s1	KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
St. Jude Children's Research Hospital Curated by ChEMBL					Assay Description Inhibition of full length human 11beta-HSD2 expressed in HEK293 cells using cortisone as substrate incubated for 2 hrs by HTRF assay in presence of N...				Eur J Med Chem 110: 126-32 (2016) BindingDB Entry DOI: 10.7270/Q28P62DG
					More data for this Ligand-Target Pair
11-beta-hydroxysteroid dehydrogenase 1 (Homo sapiens (Human))	BDBM50145432 (CHEMBL3764563) Show SMILES COc1ccc(cc1)S(=O)(=O)NCc1cn(C[C@H]2CC=C(C(C)C)[C@@]22CCC(=O)C=C2)nn1 |r,c:31,t:20| Show InChI InChI=1S/C24H30N4O4S/c1-17(2)23-9-4-18(24(23)12-10-20(29)11-13-24)15-28-16-19(26-27-28)14-25-33(30,31)22-7-5-21(32-3)6-8-22/h5-10,12,16-18,25H,4,11,13-15H2,1-3H3/t18-,24+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
St. Jude Children's Research Hospital Curated by ChEMBL					Assay Description Inhibition of 11beta-HSD1 (unknown origin) using cortisol as substrate assessed as NADPH formation by fluorescent plate reader analysis				Eur J Med Chem 110: 126-32 (2016) BindingDB Entry DOI: 10.7270/Q28P62DG
					More data for this Ligand-Target Pair