Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50038641'   

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 (GUINEA PIG)	BDBM50038641 (22-cyclopropylmethyl-(2R,13S)-14-oxa-4,22-diazahep...) Show SMILES Oc1ccc2C[C@@H]3[C@@H]4c5[nH]c6ccccc6c5C[C@@H]5Oc1c2[C@]45CCN3CC1CC1 Show InChI InChI=1S/C26H26N2O2/c29-20-8-7-15-11-19-23-24-17(16-3-1-2-4-18(16)27-24)12-21-26(23,22(15)25(20)30-21)9-10-28(19)13-14-5-6-14/h1-4,7-8,14,19,21,23,27,29H,5-6,9-13H2/t19-,21+,23-,26-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	4.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Minnesota Curated by ChEMBL					Assay Description Binding affinity against mu-opioid receptor in guinea pig brain membranes				J Med Chem 37: 1886-8 (1994) BindingDB Entry DOI: 10.7270/Q20G3KRG
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