Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50170340'   

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))	BDBM50170340 (2-(4-Bromo-phenyl)-1-(2-methyl-1-pentyl-1H-indol-3...) Show SMILES CCCCCn1c(C)c(C(=O)Cc2ccc(Br)cc2)c2ccccc12 Show InChI InChI=1S/C22H24BrNO/c1-3-4-7-14-24-16(2)22(19-8-5-6-9-20(19)24)21(25)15-17-10-12-18(23)13-11-17/h5-6,8-13H,3-4,7,14-15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.68E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Clemson University Curated by ChEMBL					Assay Description Binding affinity to displace [3H]CP-55,940 from cloned human CB2 receptor				Bioorg Med Chem Lett 15: 4110-3 (2005) Article DOI: 10.1016/j.bmcl.2005.06.008 BindingDB Entry DOI: 10.7270/Q2KD1XGV
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