Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50092580'   

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))	BDBM50092580 (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)c1 Show InChI InChI=1S/C27H36O4/c1-8-9-10-11-14-26(2,3)19-16-22(29-6)24-20-15-18(25(28)30-7)12-13-21(20)27(4,5)31-23(24)17-19/h12-13,15-17H,8-11,14H2,1-7H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt 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 1				J Med Chem 43: 3778-85 (2000) BindingDB Entry DOI: 10.7270/Q27M0754
					More data for this Ligand-Target Pair