Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50308544'   

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 2 (Homo sapiens (Human))	BDBM50308544 (2-Chloro-7-methoxy-8-pentyloxy-1-quinoline-3-carbo...) Show SMILES CCCCCOc1c(OC)ccc2cc(C(=O)NCCCc3ccccc3)c(Cl)nc12 Show InChI InChI=1S/C25H29ClN2O3/c1-3-4-8-16-31-23-21(30-2)14-13-19-17-20(24(26)28-22(19)23)25(29)27-15-9-12-18-10-6-5-7-11-18/h5-7,10-11,13-14,17H,3-4,8-9,12,15-16H2,1-2H3,(H,27,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB2 receptor				Bioorg Med Chem 18: 2099-106 (2010) Article DOI: 10.1016/j.bmc.2010.02.011 BindingDB Entry DOI: 10.7270/Q2CN741B
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