Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50381883'   

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))	BDBM50381883 (CHEMBL2022692) Show SMILES Oc1c(C(=O)NC2CCCCC2)c(=O)n(CCN2CCOCC2)c2ncccc12 Show InChI InChI=1S/C21H28N4O4/c26-18-16-7-4-8-22-19(16)25(10-9-24-11-13-29-14-12-24)21(28)17(18)20(27)23-15-5-2-1-3-6-15/h4,7-8,15,26H,1-3,5-6,9-14H2,(H,23,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	64.6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Pisa Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from recombinant human CB1 receptor expressed in human HEK293 cell membrane after 90 mins				Eur J Med Chem 52: 284-94 (2012) Article DOI: 10.1016/j.ejmech.2012.03.031 BindingDB Entry DOI: 10.7270/Q2PK0H6K
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