Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50154209'   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50154209 (8,8-Dimethyl-7-[methyl-((E)-3-phenyl-allyl)-amino]...) Show SMILES CN(C\C=C\c1ccccc1)C1CCc2ccc(O)cc2C1(C)C Show InChI InChI=1S/C22H27NO/c1-22(2)20-16-19(24)13-11-18(20)12-14-21(22)23(3)15-7-10-17-8-5-4-6-9-17/h4-11,13,16,21,24H,12,14-15H2,1-3H3/b10-7+	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bath Curated by ChEMBL					Assay Description Inhibition of [3H]DAMGO binding to human Mu opioid receptor expressed in CHO cells				J Med Chem 47: 5069-75 (2004) Article DOI: 10.1021/jm040807s BindingDB Entry DOI: 10.7270/Q2S46SQB
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