Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50176966'   

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))	BDBM50176966 (16-(3-hydroxy-4-hexylphenoxy)hexadecanoic acid (4-...) Show SMILES CCCCCCc1ccc(OCCCCCCCCCCCCCCCC(=O)Nc2ccc(O)cc2)cc1O Show InChI InChI=1S/C34H53NO4/c1-2-3-4-16-19-29-21-26-32(28-33(29)37)39-27-18-15-13-11-9-7-5-6-8-10-12-14-17-20-34(38)35-30-22-24-31(36)25-23-30/h21-26,28,36-37H,2-20,27H2,1H3,(H,35,38)	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
Universit£ degli Studi di Siena Curated by ChEMBL					Assay Description Displacement of [3H]CP-55940 from human CB1 receptor expressed in COS cells				J Med Chem 48: 7343-50 (2005) Article DOI: 10.1021/jm0501533 BindingDB Entry DOI: 10.7270/Q2FX7B7W
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