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SMILES: [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2

InChI Key: InChIKey=FOTIPSDEAZIQOX-GOTSBHOMSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50072323   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1S/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/m0/s1
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Article
PubMed
5.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


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
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1S/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/m0/s1
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Article
PubMed
9.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


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


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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1S/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/m0/s1
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Article
PubMed
53n/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