Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50520474'   

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))	BDBM50520474 (CHEMBL4443773) Show SMILES OC(=O)C(F)(F)F.CCOc1ccc(cc1CNC(=O)[C@@H](N)Cc1c(C)cc(O)cc1C)C(=O)N1CCCC1 |r| Show InChI InChI=1S/C25H33N3O4.C2HF3O2/c1-4-32-23-8-7-18(25(31)28-9-5-6-10-28)13-19(23)15-27-24(30)22(26)14-21-16(2)11-20(29)12-17(21)3;3-2(4,5)1(6)7/h7-8,11-13,22,29H,4-6,9-10,14-15,26H2,1-3H3,(H,27,30);(H,6,7)/t22-;/m0./s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	33	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Michigan Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphine from human MOR expressed in CHO cell membranes incubated for 1 hr by liquid scintillation counting assay				J Med Chem 63: 1671-1683 (2020) Article DOI: 10.1021/acs.jmedchem.9b01818 BindingDB Entry DOI: 10.7270/Q2XG9VH9
					More data for this Ligand-Target Pair