BDBM50418017 CHEMBL1682264

SMILES: OC[C@H]1CCCN1Cc1nc(ns1)-c1cn(CC2CCOCC2)c2c(Cl)cccc12

InChI Key: InChIKey=TYTSMIBSPRJKRV-MRXNPFEDSA-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 = 50418017   

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))	BDBM50418017 (CHEMBL1682264) Show SMILES OC[C@H]1CCCN1Cc1nc(ns1)-c1cn(CC2CCOCC2)c2c(Cl)cccc12 |r| Show InChI InChI=1S/C22H27ClN4O2S/c23-19-5-1-4-17-18(12-27(21(17)19)11-15-6-9-29-10-7-15)22-24-20(30-25-22)13-26-8-2-3-16(26)14-28/h1,4-5,12,15-16,28H,2-3,6-11,13-14H2/t16-/m1/s1	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	15.8	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