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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 = 'BDBM50048130'   
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))
BDBM50048130
PNG
(CHEMBL3309518)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC6CC6)CC[C@@]14[C@@]5(O)CC1=C2N(CC2CCCCC2)C(=O)CC1)ccc3O |r,c:24,THB:10:9:5.4.6:17|
Show InChI InChI=1S/C30H38N2O4/c33-22-10-8-20-14-23-30(35)15-21-9-11-24(34)32(17-18-4-2-1-3-5-18)26(21)28-29(30,25(20)27(22)36-28)12-13-31(23)16-19-6-7-19/h8,10,18-19,23,28,33,35H,1-7,9,11-17H2/t23-,28+,29+,30-/m1/s1
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Similars

Article
PubMed
0.110n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant mu opioid receptor expressed in CHO cell membranes after 60 mins by scintillation counting method


Bioorg Med Chem 22: 4067-72 (2014)


Article DOI: 10.1016/j.bmc.2014.05.065
BindingDB Entry DOI: 10.7270/Q2JM2C8P
More data for this
Ligand-Target Pair