BDBM50438098 CHEMBL2409614

SMILES: NCC[C@H](N=C1NS(=O)(=O)[C@@H]2CCCC[C@@H]2O1)c1ccccc1

InChI Key: InChIKey=PCLWNTLKYLYXOM-SOUVJXGZSA-N

Data: 1 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 1 hit for monomerid = 50438098   

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 1 (Homo sapiens (Human))	BDBM50438098 (CHEMBL2409614) Show SMILES NCC[C@H](N=C1NS(=O)(=O)[C@@H]2CCCC[C@@H]2O1)c1ccccc1 |r,w:5.5| Show InChI InChI=1S/C16H23N3O3S/c17-11-10-13(12-6-2-1-3-7-12)18-16-19-23(20,21)15-9-5-4-8-14(15)22-16/h1-3,6-7,13-15H,4-5,8-11,17H2,(H,18,19)/t13-,14-,15+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.58E+3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi Deutschland GmbH Curated by ChEMBL					Assay Description Inhibition of human 11beta-HSD1				Bioorg Med Chem Lett 23: 4685-91 (2013) Article DOI: 10.1016/j.bmcl.2013.05.102 BindingDB Entry DOI: 10.7270/Q2BV7J2H
					More data for this Ligand-Target Pair