Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM50092592'   

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))	BDBM50092592 (3-(1,1-Dimethyl-heptyl)-1-methoxy-6,6-dimethyl-6H-...) Show SMILES CCCCCCC(C)(C)c1cc(OC)c-2c(OC(C)(C)c3ccc(cc-23)C(=O)OC(C)C)c1 Show InChI InChI=1S/C29H40O4/c1-9-10-11-12-15-28(4,5)21-17-24(31-8)26-22-16-20(27(30)32-19(2)3)13-14-23(22)29(6,7)33-25(26)18-21/h13-14,16-19H,9-12,15H2,1-8H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organix, Inc. Curated by ChEMBL					Assay Description Binding affinity was determined for Cannabinoid receptor 2				J Med Chem 43: 3778-85 (2000) BindingDB Entry DOI: 10.7270/Q27M0754
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