Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50136588'   

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))	BDBM50136588 (3-[(3R,4R)-1-(4-Dimethylamino-benzyl)-3,4-dimethyl...) Show SMILES C[C@H]1CN(Cc2ccc(cc2)N(C)C)CC[C@@]1(C)c1cccc(c1)C(N)=O Show InChI InChI=1S/C23H31N3O/c1-17-15-26(16-18-8-10-21(11-9-18)25(3)4)13-12-23(17,2)20-7-5-6-19(14-20)22(24)27/h5-11,14,17H,12-13,15-16H2,1-4H3,(H2,24,27)/t17-,23+/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	5.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Adolor Corporation Curated by ChEMBL					Assay Description Inhibition of binding of the non-selective opioid antagonist, [3H]diprenorphine, to cloned human mu opioid receptor				Bioorg Med Chem Lett 13: 4459-62 (2003) BindingDB Entry DOI: 10.7270/Q2RV0P7G
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