BDBM50052686 CHEMBL115992::N-{3-[(Benzo[1,3]dioxol-5-ylmethyl)-amino]-4-methyl-phenyl}-3-cyclohexyl-propionamide

SMILES: Cc1ccc(NC(=O)CCC2CCCCC2)cc1NCc1ccc2OCOc2c1

InChI Key: InChIKey=YJJAKDIICKGMCL-UHFFFAOYSA-N

Data: 1 EC50

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 = 50052686   

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
LDL receptor (Homo sapiens (Human))	BDBM50052686 (CHEMBL115992 | N-{3-[(Benzo[1,3]dioxol-5-ylmethyl)...) Show SMILES Cc1ccc(NC(=O)CCC2CCCCC2)cc1NCc1ccc2OCOc2c1 Show InChI InChI=1S/C24H30N2O3/c1-17-7-10-20(26-24(27)12-9-18-5-3-2-4-6-18)14-21(17)25-15-19-8-11-22-23(13-19)29-16-28-22/h7-8,10-11,13-14,18,25H,2-6,9,12,15-16H2,1H3,(H,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	600	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Concentration at which one-half of the maximum Low density lipoprotein receptor is upregulated in HepG2 cells				J Med Chem 39: 3343-56 (1996) Article DOI: 10.1021/jm960153q BindingDB Entry DOI: 10.7270/Q2FT8K4S
					More data for this Ligand-Target Pair