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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1/Mu-type opioid receptor' and Ligand = 'BDBM50072344'   
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
Cannabinoid receptor 1/Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072344
PNG
(CHEMBL3409111)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-26-12-5-4-11-23(26)15-18-31-19-17-29(16-7-6-10-22-8-2-1-3-9-22)25-20-24(32)13-14-27(25)33-28(29)21-31/h1-5,8-9,11-14,20,28,32H,6-7,10,15-19,21H2/t28-,29-/s2
PDB

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DrugBank
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
BindingDB Entry DOI: 10.7270/Q2GF0W6W
More data for this
Ligand-Target Pair