Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50217080'   

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 1 (Homo sapiens (Human))	BDBM50217080 (2,6-dihydroxy-biphenyl-4-carboxylic acid pentyl es...) Show SMILES CCCCCOC(=O)c1cc(O)c(c(O)c1)-c1ccccc1 Show InChI InChI=1S/C18H20O4/c1-2-3-7-10-22-18(21)14-11-15(19)17(16(20)12-14)13-8-5-4-6-9-13/h4-6,8-9,11-12,19-20H,2-3,7,10H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Università di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]CP55,940 from human CB1 receptor				Bioorg Med Chem Lett 17: 4878-81 (2007) Checked by Author Article DOI: 10.1016/j.bmcl.2007.06.055 BindingDB Entry DOI: 10.7270/Q2QF8SKS
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