Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50401046'   

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))	BDBM50401046 (CHEMBL2206851) Show SMILES CCCCCn1c(C)c(C(=O)c2cccc3cccc(I)c23)c2ccccc12 Show InChI InChI=1S/C25H24INO/c1-3-4-7-16-27-17(2)23(19-12-5-6-15-22(19)27)25(28)20-13-8-10-18-11-9-14-21(26)24(18)20/h5-6,8-15H,3-4,7,16H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
RTI International Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from human CB2 receptor expressed in CHO cells after 1 hr by liquid scintillation spectrophotometry				Bioorg Med Chem 20: 2067-81 (2012) Article DOI: 10.1016/j.bmc.2012.01.038 BindingDB Entry DOI: 10.7270/Q2PG1SW6
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