Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50353083'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50353083 (CHEMBL1822937) Show SMILES CCCCOc1c(OC)ccc2cc(C(=O)NCc3cn(CCF)nn3)c(=O)[nH]c12 Show InChI InChI=1S/C20H24FN5O4/c1-3-4-9-30-18-16(29-2)6-5-13-10-15(20(28)23-17(13)18)19(27)22-11-14-12-26(8-7-21)25-24-14/h5-6,10,12H,3-4,7-9,11H2,1-2H3,(H,22,27)(H,23,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Texas Curated by ChEMBL					Assay Description Displacement of [3H]CP-55940 from human CB1 receptor expressed in human U87 cells after 1 hr by scintillation counting				Bioorg Med Chem 19: 5698-707 (2011) Article DOI: 10.1016/j.bmc.2011.07.062 BindingDB Entry DOI: 10.7270/Q2GH9JC3
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