BDBM50416475 CHEMBL1209807

SMILES: COCCN1[C@@H](C)CN(C[C@H]1C)C(=O)c1cn2[C@@H](COc3cccc1c23)C1CCCCC1

InChI Key: InChIKey=XMSSPOBHGWYFIL-YYDVJCTNSA-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 = 50416475   

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))	BDBM50416475 (CHEMBL1209807) Show SMILES COCCN1[C@@H](C)CN(C[C@H]1C)C(=O)c1cn2[C@@H](COc3cccc1c23)C1CCCCC1 |r| Show InChI InChI=1S/C26H37N3O3/c1-18-14-27(15-19(2)28(18)12-13-31-3)26(30)22-16-29-23(20-8-5-4-6-9-20)17-32-24-11-7-10-21(22)25(24)29/h7,10-11,16,18-20,23H,4-6,8-9,12-15,17H2,1-3H3/t18-,19+,23-/m0/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	5.01	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Agonist activity at human cannabinoid CB1 receptor expressed in CHO cells after 5 hrs by luciferase reporter gene assay				Bioorg Med Chem Lett 20: 4918-21 (2010) Article DOI: 10.1016/j.bmcl.2010.06.067 BindingDB Entry DOI: 10.7270/Q21R6RS6
					More data for this Ligand-Target Pair