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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 = 'BDBM50055067'   
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))
BDBM50055067
PNG
(CHEMBL3323514)
Show SMILES COc1ccc(CN2CCN(C3C(CCCC23)N2CCCC2)C(=O)Cc2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1/C28H35Cl2N3O2/c1-35-22-10-7-20(8-11-22)19-32-15-16-33(27(34)18-21-9-12-23(29)24(30)17-21)28-25(5-4-6-26(28)32)31-13-2-3-14-31/h7-12,17,25-26,28H,2-6,13-16,18-19H2,1H3
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
740n/an/an/an/an/an/an/an/a



Westf£lische Wilhelms-Universit£t M£nster

Curated by ChEMBL


Assay Description
Displacement of [3H]-naloxone from human mu opioid receptor expressed in CHO-K1 cells by scintillation counting analysis


J Med Chem 57: 6845-60 (2014)


Article DOI: 10.1021/jm500940q
BindingDB Entry DOI: 10.7270/Q2G73GDP
More data for this
Ligand-Target Pair