Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50026991'   

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 (Rattus norvegicus (rat))	BDBM50026991 (CHEMBL2113655) Show SMILES [H][C@@]12Cc3ccc(O)c4O[C@@]5(C)c6[nH]c7ccccc7c6C[C@]1(OCCC(C)C)[C@@]5(CCN2C)c34 |r,TLB:33:32:22:2.3.34| Show InChI InChI=1S/C29H34N2O3/c1-17(2)11-14-33-29-16-20-19-7-5-6-8-21(19)30-26(20)27(3)28(29)12-13-31(4)23(29)15-18-9-10-22(32)25(34-27)24(18)28/h5-10,17,23,30,32H,11-16H2,1-4H3/t23-,27+,28+,29-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	238	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Innsbruck Curated by ChEMBL					Assay Description Binding affinity at mu opioid receptor 1 in rat brain membrane by [3H]DAMGO displacement.				J Med Chem 45: 5378-83 (2002) BindingDB Entry DOI: 10.7270/Q2R21244
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