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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Mu-type opioid receptor' and Ligand = 'BDBM50159927'   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Mu-type opioid receptor


(Homo sapiens (Human))		BDBM50159927
PNG
(1-(1-{2-[1-(2-Chloro-5-methyl-phenoxy)-cyclohexyl]...)
Show SMILES CN(C)C(CN1CCC(CC1)n1c2ccccc2[nH]c1=O)C1(CCCCC1)Oc1cc(C)ccc1Cl
Show InChI InChI=1S/C29H39ClN4O2/c1-21-11-12-23(30)26(19-21)36-29(15-7-4-8-16-29)27(32(2)3)20-33-17-13-22(14-18-33)34-25-10-6-5-9-24(25)31-28(34)35/h5-6,9-12,19,22,27H,4,7-8,13-18,20H2,1-3H3,(H,31,35)
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Similars
Article
PubMed
 102n/an/an/an/an/an/an/an/a



Organon Laboratories Ltd

Curated by ChEMBL


Assay Description
Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...

Bioorg Med Chem Lett 15: 589-93 (2005)


Article DOI: 10.1016/j.bmcl.2004.11.049
BindingDB Entry DOI: 10.7270/Q2K35T50
More data for this
Ligand-Target Pair