BDBM50388899 CHEMBL2063121

SMILES: CNC1CCCOc2c1nn(c2-c1ccc(Cl)cc1)-c1ccccc1Cl

InChI Key: InChIKey=XQSBDSKMUJXCRO-UHFFFAOYSA-N

Data: 1 KI

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 = 50388899   

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))	BDBM50388899 (CHEMBL2063121) Show SMILES CNC1CCCOc2c1nn(c2-c1ccc(Cl)cc1)-c1ccccc1Cl Show InChI InChI=1S/C20H19Cl2N3O/c1-23-16-6-4-12-26-20-18(16)24-25(17-7-3-2-5-15(17)22)19(20)13-8-10-14(21)11-9-13/h2-3,5,7-11,16,23H,4,6,12H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	46	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Displacement of [3H]SR141716A form human CB1 receptor expressed in HEK293 cells after 60 mins by beta counting				ACS Med Chem Lett 3: 397-401 (2012) Article DOI: 10.1021/ml3000325 BindingDB Entry DOI: 10.7270/Q22N53BD
					More data for this Ligand-Target Pair