BDBM50325884 CHEMBL1224458::N-(1-(3-(benzo[d][1,3]dioxol-4-yl)benzyl)-1H-indol-6-yl)pivalamide

SMILES: CC(C)(C)C(=O)Nc1ccc2ccn(Cc3cccc(c3)-c3cccc4OCOc34)c2c1

InChI Key: InChIKey=ZBARPSHFQJVZLO-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50325884   

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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50325884 (CHEMBL1224458 | N-(1-(3-(benzo[d][1,3]dioxol-4-yl)...) Show SMILES CC(C)(C)C(=O)Nc1ccc2ccn(Cc3cccc(c3)-c3cccc4OCOc34)c2c1 Show InChI InChI=1S/C27H26N2O3/c1-27(2,3)26(30)28-21-11-10-19-12-13-29(23(19)15-21)16-18-6-4-7-20(14-18)22-8-5-9-24-25(22)32-17-31-24/h4-15H,16-17H2,1-3H3,(H,28,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	51	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals, Inc. Curated by ChEMBL					Assay Description Displacement of [3H]CC55940 human cannabinoid CB1 receptor expressed in CHO cells by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 5449-53 (2010) Article DOI: 10.1016/j.bmcl.2010.07.091 BindingDB Entry DOI: 10.7270/Q2SN0958
					More data for this Ligand-Target Pair