Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50529414'   

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))	BDBM50529414 (CHEMBL4578287) Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccc(O)cc2)CC1)C(=O)OC Show InChI InChI=1S/C24H30N2O4/c1-3-22(28)26(20-7-5-4-6-8-20)24(23(29)30-2)14-17-25(18-15-24)16-13-19-9-11-21(27)12-10-19/h4-12,27H,3,13-18H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	0.0280	n/a	n/a	n/a	n/a
United States Army CCDC Chemical Biological Center Curated by ChEMBL					Assay Description Agonist activity at human MOR expressed in CHO-K1 cells assessed as cAMP accumulation incubated for 30 mins and measured after 1 hr by Eu-cAMP tracer...				ACS Med Chem Lett 10: 1568-1572 (2019) Article DOI: 10.1021/acsmedchemlett.9b00404 BindingDB Entry DOI: 10.7270/Q2JD5175
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