Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50213892'   

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))	BDBM50213892 (3-[(Z)-quinolin-5-ylimino]-2-thia-4-aza-spiro[5.5]...) Show SMILES CSC(=S)N1CC2(CCCCC2)CS\C1=N/c1cccc2ncccc12 Show InChI InChI=1S/C20H23N3S3/c1-25-19(24)23-13-20(10-3-2-4-11-20)14-26-18(23)22-17-9-5-8-16-15(17)7-6-12-21-16/h5-9,12H,2-4,10-11,13-14H2,1H3/b22-18-	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	11	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Shionogi & Co. Ltd Curated by ChEMBL					Assay Description Binding affinity to human CB2 receptor				Bioorg Med Chem Lett 17: 3925-9 (2007) Article DOI: 10.1016/j.bmcl.2007.04.099 BindingDB Entry DOI: 10.7270/Q2RX9BR5
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