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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 = 'BDBM50174104'   
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))
BDBM50174104
PNG
(CHEMBL3809145)
Show SMILES COc1cccc(c1)[C@]1(O)[C@@H](CN(C)C)CCc2cc(ccc12)-c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C27H28F3NO2/c1-31(2)17-23-13-9-20-15-19(18-7-11-21(12-8-18)27(28,29)30)10-14-25(20)26(23,32)22-5-4-6-24(16-22)33-3/h4-8,10-12,14-16,23,32H,9,13,17H2,1-3H3/t23-,26+/m1/s1
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PC cid
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Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Fudan University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human MOR expressed in CHO cell membranes after 60 mins


ACS Med Chem Lett 7: 391-6 (2016)


Article DOI: 10.1021/acsmedchemlett.5b00423
BindingDB Entry DOI: 10.7270/Q2R78H4W
More data for this
Ligand-Target Pair