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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 = 'BDBM50108442'   
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))
BDBM50108442
PNG
(3-Naphthalen-2-yl-1-(1-phenyl-2-pyrrolidin-1-yl-et...)
Show SMILES O=c1c(cccn1C(CN1CCCC1)c1ccccc1)-c1ccc2ccccc2c1
Show InChI InChI=1S/C27H26N2O/c30-27-25(24-15-14-21-9-4-5-12-23(21)19-24)13-8-18-29(27)26(20-28-16-6-7-17-28)22-10-2-1-3-11-22/h1-5,8-15,18-19,26H,6-7,16-17,20H2
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.68E+3n/an/an/an/an/an/a



AstraZeneca R&D Mölndal

Curated by ChEMBL


Assay Description
Binding affinity towards mu opioid receptor by the displacement of [125I]-Enkephalin


Bioorg Med Chem Lett 12: 197-200 (2001)


BindingDB Entry DOI: 10.7270/Q28051XH
More data for this
Ligand-Target Pair