BDBM50418006 CHEMBL1682265

SMILES: OC(=O)C1CCCN1Cc1nc(ns1)-c1cn(CC2CCOCC2)c2c(Cl)cccc12

InChI Key: InChIKey=KWOKALIQPMDDRZ-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 = 50418006   

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))	BDBM50418006 (CHEMBL1682265) Show SMILES OC(=O)C1CCCN1Cc1nc(ns1)-c1cn(CC2CCOCC2)c2c(Cl)cccc12 Show InChI InChI=1S/C22H25ClN4O3S/c23-17-4-1-3-15-16(12-27(20(15)17)11-14-6-9-30-10-7-14)21-24-19(31-25-21)13-26-8-2-5-18(26)22(28)29/h1,3-4,12,14,18H,2,5-11,13H2,(H,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	158	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Agonist activity at human cannabinoid CB1 receptor expressed in CHO cells by luciferase reporter gene assay				Bioorg Med Chem Lett 21: 1748-53 (2011) Article DOI: 10.1016/j.bmcl.2011.01.082 BindingDB Entry DOI: 10.7270/Q2HD7WWG
					More data for this Ligand-Target Pair