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Compile Data Set for Download or QSAR

Found 3 hits of ki for monomerid = 50002074   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50002074
PNG
(CHEMBL611133)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@H](Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30-,31+,32-/m1/s1
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18n/an/an/an/an/an/an/an/a



University of Medicine & Dentistry of New Jersey-Robert Wood Johnson Medical School (UMDNJ-RWJMS)

Curated by ChEMBL


Assay Description
Binding affinity against Opioid receptor delta 1 from rat brain membranes using [3H]DADLE


J Med Chem 48: 1620-9 (2005)

Checked by Author
Article DOI: 10.1021/jm049117e
BindingDB Entry DOI: 10.7270/Q2ZP47MP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50002074
PNG
(CHEMBL611133)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@H](Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30-,31+,32-/m1/s1
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631n/an/an/an/an/an/an/an/a



University of Medicine & Dentistry of New Jersey-Robert Wood Johnson Medical School (UMDNJ-RWJMS)

Curated by ChEMBL


Assay Description
Binding affinity against Opioid receptor kappa 1 from guinea pig brain membranes using [3H]U-69593


J Med Chem 48: 1620-9 (2005)

Checked by Author
Article DOI: 10.1021/jm049117e
BindingDB Entry DOI: 10.7270/Q2ZP47MP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50002074
PNG
(CHEMBL611133)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@H](Oc1c24)c1[nH]c2cc(ccc2c1C[C@@]35O)-c1ccccc1
Show InChI InChI=1S/C32H30N2O3/c35-25-11-9-21-15-26-32(36)16-23-22-10-8-20(19-4-2-1-3-5-19)14-24(22)33-28(23)30-31(32,27(21)29(25)37-30)12-13-34(26)17-18-6-7-18/h1-5,8-11,14,18,26,30,33,35-36H,6-7,12-13,15-17H2/t26-,30-,31+,32-/m1/s1
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1.29E+3n/an/an/an/an/an/an/an/a



University of Medicine & Dentistry of New Jersey-Robert Wood Johnson Medical School (UMDNJ-RWJMS)

Curated by ChEMBL


Assay Description
Binding affinity against Opioid receptor mu 1 from rat brain membranes using [3H]DAMGO


J Med Chem 48: 1620-9 (2005)

Checked by Author
Article DOI: 10.1021/jm049117e
BindingDB Entry DOI: 10.7270/Q2ZP47MP
More data for this
Ligand-Target Pair