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Compile Data Set for Download or QSAR

Found 86 hits with Last Name = 'kurimura' and Initial = 'm'   
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
Vasopressin V2 receptor


(Homo sapiens (Human))
BDBM35723
PNG
(CHEMBL344159 | N-[4-(7-Chloro-5-hydroxy-2,3,4,5-te...)
Show SMILES Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(O)c3cc(Cl)ccc23)c(C)c1
Show InChI InChI=1S/C26H25ClN2O3/c1-16-6-3-4-7-20(16)25(31)28-19-10-11-21(17(2)14-19)26(32)29-13-5-8-24(30)22-15-18(27)9-12-23(22)29/h3-4,6-7,9-12,14-15,24,30H,5,8,13H2,1-2H3,(H,28,31)
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0.430n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Concentration of the compound which inhibit [3H]-AVP binding to human Vasopressin V2 receptor coded HeLa cells by 50%


J Med Chem 43: 4388-97 (2000)


BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273464
PNG
((1S,9S,10S)-11-(2-phenylethyl)-8-oxa-11-azatetracy...)
Show SMILES Oc1cccc2c1O[C@@H]1[C@@H]3CCC[C@]21CCN3CCc1ccccc1 |r,THB:17:16:8:10.11.12|
Show InChI InChI=1S/C22H25NO2/c24-19-10-4-8-17-20(19)25-21-18-9-5-12-22(17,21)13-15-23(18)14-11-16-6-2-1-3-7-16/h1-4,6-8,10,18,21,24H,5,9,11-15H2/t18-,21+,22-/m0/s1
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7n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Vasopressin V2 receptor


(Homo sapiens (Human))
BDBM35714
PNG
(CHEMBL420762 | Mozavaptan | N-[4-(5-Dimethylamino-...)
Show SMILES CN(C)C1CCCN(C(=O)c2ccc(NC(=O)c3ccccc3C)cc2)c2ccccc12
Show InChI InChI=1S/C27H29N3O2/c1-19-9-4-5-10-22(19)26(31)28-21-16-14-20(15-17-21)27(32)30-18-8-13-24(29(2)3)23-11-6-7-12-25(23)30/h4-7,9-12,14-17,24H,8,13,18H2,1-3H3,(H,28,31)
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9.42n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Concentration of the compound which inhibit [3H]-AVP binding to human Vasopressin V2 receptor coded HeLa cells by 50%


J Med Chem 43: 4388-97 (2000)


BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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26n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Vasopressin V1a receptor


(RAT)
BDBM50029644
PNG
(CHEMBL296908 | N-(3-(4-(4-(2-oxo-3,4-dihydroquinol...)
Show SMILES CC(=O)NCCCOc1ccc(cc1)C(=O)N1CCC(CC1)N1C(=O)CCc2ccccc12
Show InChI InChI=1S/C26H31N3O4/c1-19(30)27-15-4-18-33-23-10-7-21(8-11-23)26(32)28-16-13-22(14-17-28)29-24-6-3-2-5-20(24)9-12-25(29)31/h2-3,5-8,10-11,22H,4,9,12-18H2,1H3,(H,27,30)
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32n/an/an/an/an/an/an/an/a



Otsuka Pharmaceutical Company

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards Vasopressin V1a receptor in rat liver


J Med Chem 43: 4388-97 (2000)


BindingDB Entry DOI: 10.7270/Q2PG1R04
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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42n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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49n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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78n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348870
PNG
(CHEMBL1808302)
Show SMILES Oc1ccc2O[C@@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21-,22-/m1/s1
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98n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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102n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348869
PNG
(CHEMBL1808300)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20-,22-/m1/s1
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167n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348869
PNG
(CHEMBL1808300)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20-,22-/m1/s1
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171n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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190n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348871
PNG
(CHEMBL1808303)
Show SMILES Oc1ccc2O[C@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21+,22-/m1/s1
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199n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273414
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1cccc2c1O[C@H]1CN(CCc3ccccc3)[C@@H]3CCC[C@]21C3 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-10-4-9-18-21(19)25-20-15-23(13-11-16-6-2-1-3-7-16)17-8-5-12-22(18,20)14-17/h1-4,6-7,9-10,17,20,24H,5,8,11-15H2/t17?,20-,22-/m0/s1
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200n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348871
PNG
(CHEMBL1808303)
Show SMILES Oc1ccc2O[C@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21+,22-/m1/s1
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250n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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352n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348872
PNG
(CHEMBL1808304)
Show SMILES Oc1cccc2c1O[C@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20+,22-/m1/s1
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367n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348872
PNG
(CHEMBL1808304)
Show SMILES Oc1cccc2c1O[C@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20+,22-/m1/s1
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384n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348870
PNG
(CHEMBL1808302)
Show SMILES Oc1ccc2O[C@@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21-,22-/m1/s1
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486n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273416
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1ccc2O[C@H]3CN(CCc4ccccc4)[C@@H]4CCC[C@]3(C4)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-8-9-20-19(13-18)22-11-4-7-17(14-22)23(15-21(22)25-20)12-10-16-5-2-1-3-6-16/h1-3,5-6,8-9,13,17,21,24H,4,7,10-12,14-15H2/t17?,21-,22-/m0/s1
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560n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273414
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1cccc2c1O[C@H]1CN(CCc3ccccc3)[C@@H]3CCC[C@]21C3 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-10-4-9-18-21(19)25-20-15-23(13-11-16-6-2-1-3-7-16)17-8-5-12-22(18,20)14-17/h1-4,6-7,9-10,17,20,24H,5,8,11-15H2/t17?,20-,22-/m0/s1
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560n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273415
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3ccc(O)cc3[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-14-15(6-2-3-10(16)8-15)12-7-11(17)4-5-13(12)18-14/h4-5,7,10,14,17H,2-3,6,8-9H2,1H3/t10?,14-,15-/m0/s1
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620n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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740n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273934
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-methyl-1...)
Show SMILES CN1CC[C@@]23C[C@@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10?,13-,15+/m1/s1
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910n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273416
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1ccc2O[C@H]3CN(CCc4ccccc4)[C@@H]4CCC[C@]3(C4)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-8-9-20-19(13-18)22-11-4-7-17(14-22)23(15-21(22)25-20)12-10-16-5-2-1-3-6-16/h1-3,5-6,8-9,13,17,21,24H,4,7,10-12,14-15H2/t17?,21-,22-/m0/s1
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1.22E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273416
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1ccc2O[C@H]3CN(CCc4ccccc4)[C@@H]4CCC[C@]3(C4)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-8-9-20-19(13-18)22-11-4-7-17(14-22)23(15-21(22)25-20)12-10-16-5-2-1-3-6-16/h1-3,5-6,8-9,13,17,21,24H,4,7,10-12,14-15H2/t17?,21-,22-/m0/s1
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2.53E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273415
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3ccc(O)cc3[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-14-15(6-2-3-10(16)8-15)12-7-11(17)4-5-13(12)18-14/h4-5,7,10,14,17H,2-3,6,8-9H2,1H3/t10?,14-,15-/m0/s1
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2.78E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348868
PNG
(CHEMBL1808301)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1ccc(O)cc31 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-7-6-15-9-10(16)2-5-14(15)18-13-4-3-11(17)8-12(13)15/h3-4,8,10,14,17H,2,5-7,9H2,1H3/t10-,14-,15-/m1/s1
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>2.80E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50348867
PNG
(CHEMBL1808299)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10-,13-,15-/m1/s1
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>2.80E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273414
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-pheneth...)
Show SMILES Oc1cccc2c1O[C@H]1CN(CCc3ccccc3)[C@@H]3CCC[C@]21C3 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-10-4-9-18-21(19)25-20-15-23(13-11-16-6-2-1-3-7-16)17-8-5-12-22(18,20)14-17/h1-4,6-7,9-10,17,20,24H,5,8,11-15H2/t17?,20-,22-/m0/s1
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2.84E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273415
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3ccc(O)cc3[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-14-15(6-2-3-10(16)8-15)12-7-11(17)4-5-13(12)18-14/h4-5,7,10,14,17H,2-3,6,8-9H2,1H3/t10?,14-,15-/m0/s1
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>2.93E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273934
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-methyl-1...)
Show SMILES CN1CC[C@@]23C[C@@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10?,13-,15+/m1/s1
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3.21E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273413
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3c(cccc3O)[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-13-15(7-3-4-10(16)8-15)11-5-2-6-12(17)14(11)18-13/h2,5-6,10,13,17H,3-4,7-9H2,1H3/t10?,13-,15-/m0/s1
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3.43E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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3.71E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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4.76E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50273413
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3c(cccc3O)[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-13-15(7-3-4-10(16)8-15)11-5-2-6-12(17)14(11)18-13/h2,5-6,10,13,17H,3-4,7-9H2,1H3/t10?,13-,15-/m0/s1
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4.82E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348869
PNG
(CHEMBL1808300)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20-,22-/m1/s1
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>4.90E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348870
PNG
(CHEMBL1808302)
Show SMILES Oc1ccc2O[C@@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21-,22-/m1/s1
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>4.90E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348868
PNG
(CHEMBL1808301)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1ccc(O)cc31 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-7-6-15-9-10(16)2-5-14(15)18-13-4-3-11(17)8-12(13)15/h3-4,8,10,14,17H,2,5-7,9H2,1H3/t10-,14-,15-/m1/s1
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>4.90E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348867
PNG
(CHEMBL1808299)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10-,13-,15-/m1/s1
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>4.90E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348872
PNG
(CHEMBL1808304)
Show SMILES Oc1cccc2c1O[C@H]1CC[C@@H]3C[C@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17-,20+,22-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50348871
PNG
(CHEMBL1808303)
Show SMILES Oc1ccc2O[C@H]3CC[C@@H]4C[C@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17-,21+,22-/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273933
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1 |r|
Show InChI InChI=1S/C22H25NO2/c24-18-7-8-20-19(14-18)22-11-13-23(12-10-16-4-2-1-3-5-16)17(15-22)6-9-21(22)25-20/h1-5,7-8,14,17,21,24H,6,9-13,15H2/t17?,21-,22+/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273935
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...)
Show SMILES Oc1cccc2c1O[C@@H]1CC[C@H]3C[C@@]21CCN3CCc1ccccc1 |r|
Show InChI InChI=1S/C22H25NO2/c24-19-8-4-7-18-21(19)25-20-10-9-17-15-22(18,20)12-14-23(17)13-11-16-5-2-1-3-6-16/h1-8,17,20,24H,9-15H2/t17?,20-,22+/m1/s1
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>5.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348867
PNG
(CHEMBL1808299)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10-,13-,15-/m1/s1
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7.50E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50273413
PNG
((3R*,6aS*,11aR*)-1,3,4,5,6,11a-Hexahydro-2-methyl-...)
Show SMILES CN1C[C@@H]2Oc3c(cccc3O)[C@@]22CCC[C@@H]1C2 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-9-13-15(7-3-4-10(16)8-15)11-5-2-6-12(17)14(11)18-13/h2,5-6,10,13,17H,3-4,7-9H2,1H3/t10?,13-,15-/m0/s1
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>8.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50348868
PNG
(CHEMBL1808301)
Show SMILES CN1CC[C@]23C[C@H]1CC[C@H]2Oc1ccc(O)cc31 |r|
Show InChI InChI=1S/C15H19NO2/c1-16-7-6-15-9-10(16)2-5-14(15)18-13-4-3-11(17)8-12(13)15/h3-4,8,10,14,17H,2,5-7,9H2,1H3/t10-,14-,15-/m1/s1
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>8.60E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla...


Bioorg Med Chem 19: 4330-7 (2011)


Article DOI: 10.1016/j.bmc.2011.05.035
BindingDB Entry DOI: 10.7270/Q2902452
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50273934
PNG
((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-methyl-1...)
Show SMILES CN1CC[C@@]23C[C@@H]1CC[C@H]2Oc1c3cccc1O |r|
Show InChI InChI=1S/C15H19NO2/c1-16-8-7-15-9-10(16)5-6-13(15)18-14-11(15)3-2-4-12(14)17/h2-4,10,13,17H,5-9H2,1H3/t10?,13-,15+/m1/s1
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1.00E+4n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells


J Med Chem 51: 7866-81 (2008)


Article DOI: 10.1021/jm800913d
BindingDB Entry DOI: 10.7270/Q2639PM8
More data for this
Ligand-Target Pair
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