Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50259552'   

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))	BDBM50259552 (CHEMBL3084558 | endo-methyl 8-(bis(2-chlorophenyl)...) Show SMILES [H][C@]12CC[C@]([H])(C[C@](Cc3ccc(Cl)cc3)(C1)NC(=O)OC)N2C(c1ccccc1Cl)c1ccccc1Cl |r,TLB:17:7:22:3.2| Show InChI InChI=1S/C29H29Cl3N2O2/c1-36-28(35)33-29(16-19-10-12-20(30)13-11-19)17-21-14-15-22(18-29)34(21)27(23-6-2-4-8-25(23)31)24-7-3-5-9-26(24)32/h2-13,21-22,27H,14-18H2,1H3,(H,33,35)/t21-,22-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.56E+3	n/a	n/a	n/a	n/a
Schering-Plough Research Institute Curated by ChEMBL					Assay Description Agonist activity at human mu opioid assessed as stimulation of GTPgammaS binding				Bioorg Med Chem Lett 19: 2482-6 (2009) Article DOI: 10.1016/j.bmcl.2009.03.057 BindingDB Entry DOI: 10.7270/Q2D21XH9
					More data for this Ligand-Target Pair