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PubMed code 17887741

Compile data set for download or QSAR
Found 133 hits of Enzyme Inhibition Constant Data   
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
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027230
PNG
(CHEMBL2113666)
Show SMILES CN1CC[C@]23[C@H]4Oc5cccc(C[C@@H]1[C@@]2(CCC4=O)NC(=O)\C=C\c1ccccc1Cl)c35
Show InChI InChI=1S/C26H25ClN2O3/c1-29-14-13-25-23-17-6-4-8-20(23)32-24(25)19(30)11-12-26(25,21(29)15-17)28-22(31)10-9-16-5-2-3-7-18(16)27/h2-10,21,24H,11-15H2,1H3,(H,28,31)/b10-9+/t21-,24+,25+,26-/m1/s1
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PubMed
0.0800n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027235
PNG
(CHEMBL2113304)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-6-4-5-7-20(19)9-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-8-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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0.140n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027230
PNG
(CHEMBL2113666)
Show SMILES CN1CC[C@]23[C@H]4Oc5cccc(C[C@@H]1[C@@]2(CCC4=O)NC(=O)\C=C\c1ccccc1Cl)c35
Show InChI InChI=1S/C26H25ClN2O3/c1-29-14-13-25-23-17-6-4-8-20(23)32-24(25)19(30)11-12-26(25,21(29)15-17)28-22(31)10-9-16-5-2-3-7-18(16)27/h2-10,21,24H,11-15H2,1H3,(H,28,31)/b10-9+/t21-,24+,25+,26-/m1/s1
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0.150n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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0.180n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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0.190n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM60212
PNG
((4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-bis(o...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O
Show InChI InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1
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0.200n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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0.220n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027243
PNG
(CHEMBL2113306)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-4-6-20(7-5-19)8-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-9-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-8+/t22-,24-,28-,29-,30+,31+/m1/s1
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0.230n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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0.25n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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0.25n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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0.390n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM60212
PNG
((4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-bis(o...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O
Show InChI InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1
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0.400n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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0.480n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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0.520n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027230
PNG
(CHEMBL2113666)
Show SMILES CN1CC[C@]23[C@H]4Oc5cccc(C[C@@H]1[C@@]2(CCC4=O)NC(=O)\C=C\c1ccccc1Cl)c35
Show InChI InChI=1S/C26H25ClN2O3/c1-29-14-13-25-23-17-6-4-8-20(23)32-24(25)19(30)11-12-26(25,21(29)15-17)28-22(31)10-9-16-5-2-3-7-18(16)27/h2-10,21,24H,11-15H2,1H3,(H,28,31)/b10-9+/t21-,24+,25+,26-/m1/s1
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0.540n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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0.630n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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0.680n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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0.740n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50026603
PNG
(BUPRENORPHINE | Buprenorphine | CHEBI:3216)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
Show InChI InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
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0.800n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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0.870n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
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
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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1.10n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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1.40n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50026603
PNG
(BUPRENORPHINE | Buprenorphine | CHEBI:3216)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
Show InChI InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
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1.5n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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1.70n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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1.70n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027235
PNG
(CHEMBL2113304)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-6-4-5-7-20(19)9-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-8-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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1.80n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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1.90n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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2n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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2.40n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027253
PNG
(CHEMBL2113298)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-7-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-6-19-4-8-22(32)9-5-19/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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2.60n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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3n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027243
PNG
(CHEMBL2113306)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-4-6-20(7-5-19)8-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-9-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-8+/t22-,24-,28-,29-,30+,31+/m1/s1
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3.10n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027235
PNG
(CHEMBL2113304)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-6-4-5-7-20(19)9-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-8-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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3.40n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50026603
PNG
(BUPRENORPHINE | Buprenorphine | CHEBI:3216)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
Show InChI InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
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PubMed
4.5n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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4.80n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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5.30n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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5.40n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027243
PNG
(CHEMBL2113306)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-4-6-20(7-5-19)8-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-9-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-8+/t22-,24-,28-,29-,30+,31+/m1/s1
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6.5n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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6.60n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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7.60n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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8n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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10n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027250
PNG
(CHEMBL2113309)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H38N2O3/c1-33-17-15-30-26-22-11-12-24(34-2)27(26)36-28(30)31(35-3)14-13-29(30,25(33)18-22)19-23(31)20-32-16-7-10-21-8-5-4-6-9-21/h4-12,23,25,28,32H,13-20H2,1-3H3/b10-7+/t23-,25-,28-,29-,30+,31+/m1/s1
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11n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM60212
PNG
((4R,4aS,7aR,12bS)-3-(cyclopropylmethyl)-4a,9-bis(o...)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)C(=O)CC[C@@]35O
Show InChI InChI=1S/C20H23NO4/c22-13-4-3-12-9-15-20(24)6-5-14(23)18-19(20,16(12)17(13)25-18)7-8-21(15)10-11-1-2-11/h3-4,11,15,18,22,24H,1-2,5-10H2/t15-,18+,19+,20-/m1/s1
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11n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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11n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027252
PNG
(CHEMBL2113297)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-5-7-21(8-6-20)9-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-10-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-9+/t23-,25-,29-,30-,31+,32+/m1/s1
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12n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027237
PNG
(CHEMBL2113302)
Show SMILES COc1ccc(\C=C\C(=O)NC[C@H]2C[C@]34CC[C@@]2(OC)[C@@H]2Oc5c6c(C[C@H]3N(C)CC[C@@]426)ccc5OC)cc1
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-8-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-7-20-5-9-23(36-2)10-6-20/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-7+/t22-,25-,29-,30-,31+,32+/m1/s1
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13n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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21n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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22n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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24n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027250
PNG
(CHEMBL2113309)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H38N2O3/c1-33-17-15-30-26-22-11-12-24(34-2)27(26)36-28(30)31(35-3)14-13-29(30,25(33)18-22)19-23(31)20-32-16-7-10-21-8-5-4-6-9-21/h4-12,23,25,28,32H,13-20H2,1-3H3/b10-7+/t23-,25-,28-,29-,30+,31+/m1/s1
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26n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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30n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027251
PNG
(CHEMBL2113310)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H37ClN2O3/c1-34-16-14-30-26-21-8-11-24(35-2)27(26)37-28(30)31(36-3)13-12-29(30,25(34)17-21)18-22(31)19-33-15-4-5-20-6-9-23(32)10-7-20/h4-11,22,25,28,33H,12-19H2,1-3H3/b5-4+/t22-,25-,28-,29-,30+,31+/m1/s1
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34n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human cloned mu opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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39n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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45n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-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
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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47n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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58n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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60n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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66n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027251
PNG
(CHEMBL2113310)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H37ClN2O3/c1-34-16-14-30-26-21-8-11-24(35-2)27(26)37-28(30)31(36-3)13-12-29(30,25(34)17-21)18-22(31)19-33-15-4-5-20-6-9-23(32)10-7-20/h4-11,22,25,28,33H,12-19H2,1-3H3/b5-4+/t22-,25-,28-,29-,30+,31+/m1/s1
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68n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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86n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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88n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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94n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027237
PNG
(CHEMBL2113302)
Show SMILES COc1ccc(\C=C\C(=O)NC[C@H]2C[C@]34CC[C@@]2(OC)[C@@H]2Oc5c6c(C[C@H]3N(C)CC[C@@]426)ccc5OC)cc1
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-8-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-7-20-5-9-23(36-2)10-6-20/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-7+/t22-,25-,29-,30-,31+,32+/m1/s1
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109n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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111n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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133n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-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
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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140n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027253
PNG
(CHEMBL2113298)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-7-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-6-19-4-8-22(32)9-5-19/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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155n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027252
PNG
(CHEMBL2113297)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-5-7-21(8-6-20)9-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-10-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-9+/t23-,25-,29-,30-,31+,32+/m1/s1
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159n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69593 from human cloned kappa opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027252
PNG
(CHEMBL2113297)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-5-7-21(8-6-20)9-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-10-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-9+/t23-,25-,29-,30-,31+,32+/m1/s1
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246n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027253
PNG
(CHEMBL2113298)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-7-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-6-19-4-8-22(32)9-5-19/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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289n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027237
PNG
(CHEMBL2113302)
Show SMILES COc1ccc(\C=C\C(=O)NC[C@H]2C[C@]34CC[C@@]2(OC)[C@@H]2Oc5c6c(C[C@H]3N(C)CC[C@@]426)ccc5OC)cc1
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-8-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-7-20-5-9-23(36-2)10-6-20/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-7+/t22-,25-,29-,30-,31+,32+/m1/s1
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322n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027250
PNG
(CHEMBL2113309)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H38N2O3/c1-33-17-15-30-26-22-11-12-24(34-2)27(26)36-28(30)31(35-3)14-13-29(30,25(33)18-22)19-23(31)20-32-16-7-10-21-8-5-4-6-9-21/h4-12,23,25,28,32H,13-20H2,1-3H3/b10-7+/t23-,25-,28-,29-,30+,31+/m1/s1
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395n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (human))
BDBM50027251
PNG
(CHEMBL2113310)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H37ClN2O3/c1-34-16-14-30-26-21-8-11-24(35-2)27(26)37-28(30)31(36-3)13-12-29(30,25(34)17-21)18-22(31)19-33-15-4-5-20-6-9-23(32)10-7-20/h4-11,22,25,28,33H,12-19H2,1-3H3/b5-4+/t22-,25-,28-,29-,30+,31+/m1/s1
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742n/an/an/an/an/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human cloned delta opioid receptor


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027237
PNG
(CHEMBL2113302)
Show SMILES COc1ccc(\C=C\C(=O)NC[C@H]2C[C@]34CC[C@@]2(OC)[C@@H]2Oc5c6c(C[C@H]3N(C)CC[C@@]426)ccc5OC)cc1
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-8-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-7-20-5-9-23(36-2)10-6-20/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-7+/t22-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 74n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 216n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027251
PNG
(CHEMBL2113310)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H37ClN2O3/c1-34-16-14-30-26-21-8-11-24(35-2)27(26)37-28(30)31(36-3)13-12-29(30,25(34)17-21)18-22(31)19-33-15-4-5-20-6-9-23(32)10-7-20/h4-11,22,25,28,33H,12-19H2,1-3H3/b5-4+/t22-,25-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 233n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027237
PNG
(CHEMBL2113302)
Show SMILES COc1ccc(\C=C\C(=O)NC[C@H]2C[C@]34CC[C@@]2(OC)[C@@H]2Oc5c6c(C[C@H]3N(C)CC[C@@]426)ccc5OC)cc1
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-8-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-7-20-5-9-23(36-2)10-6-20/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-7+/t22-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 680n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 133n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027235
PNG
(CHEMBL2113304)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-6-4-5-7-20(19)9-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-8-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 7.20n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027243
PNG
(CHEMBL2113306)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-4-6-20(7-5-19)8-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-9-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-8+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 9.90n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 8.60n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 63n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 57n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 14n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 42n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50026603
PNG
(BUPRENORPHINE | Buprenorphine | CHEBI:3216)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
Show InChI InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
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n/an/an/an/a 15n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 3.10n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 160n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 1.80n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 3.5n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 7.5n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 159n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 26n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-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
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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n/an/an/an/a 484n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027250
PNG
(CHEMBL2113309)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H38N2O3/c1-33-17-15-30-26-22-11-12-24(34-2)27(26)36-28(30)31(35-3)14-13-29(30,25(33)18-22)19-23(31)20-32-16-7-10-21-8-5-4-6-9-21/h4-12,23,25,28,32H,13-20H2,1-3H3/b10-7+/t23-,25-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 139n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 5.40n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027251
PNG
(CHEMBL2113310)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)OC
Show InChI InChI=1S/C31H37ClN2O3/c1-34-16-14-30-26-21-8-11-24(35-2)27(26)37-28(30)31(36-3)13-12-29(30,25(34)17-21)18-22(31)19-33-15-4-5-20-6-9-23(32)10-7-20/h4-11,22,25,28,33H,12-19H2,1-3H3/b5-4+/t22-,25-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 149n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 106n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
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
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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n/an/an/an/a 316n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 285n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 74n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 11n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 2.60n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 0.300n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027235
PNG
(CHEMBL2113304)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-6-4-5-7-20(19)9-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-8-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 0.25n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 2.5n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027245
PNG
(CHEMBL2113294)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H36N2O4/c1-33-16-15-30-26-21-10-11-23(35-2)27(26)37-28(30)31(36-3)14-13-29(30,24(33)17-21)18-22(31)19-32-25(34)12-9-20-7-5-4-6-8-20/h4-12,22,24,28H,13-19H2,1-3H3,(H,32,34)/b12-9+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 131n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027236
PNG
(CHEMBL2113305)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-7-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-8-18-5-3-4-6-21(18)31/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-8+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 3.40n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027239
PNG
(CHEMBL2113300 | SJ000091719)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-8-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-9-19-6-4-5-7-22(19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 14n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027250
PNG
(CHEMBL2113309)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC\C=C\c1ccccc1)OC
Show InChI InChI=1S/C31H38N2O3/c1-33-17-15-30-26-22-11-12-24(34-2)27(26)36-28(30)31(35-3)14-13-29(30,25(33)18-22)19-23(31)20-32-16-7-10-21-8-5-4-6-9-21/h4-12,23,25,28,32H,13-20H2,1-3H3/b10-7+/t23-,25-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 106n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 42n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027252
PNG
(CHEMBL2113297)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-5-7-21(8-6-20)9-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-10-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-9+/t23-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 290n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 164n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027238
PNG
(CHEMBL2113303)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H34N2O4/c1-32-15-14-29-25-20-9-10-22(33)26(25)36-27(29)30(35-2)13-12-28(29,23(32)16-20)17-21(30)18-31-24(34)11-8-19-6-4-3-5-7-19/h3-11,21,23,27,33H,12-18H2,1-2H3,(H,31,34)/b11-8+/t21-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 59n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 3.10n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027240
PNG
(CHEMBL2113301)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1OC)OC
Show InChI InChI=1S/C32H38N2O5/c1-34-16-15-31-27-21-9-11-24(37-3)28(27)39-29(31)32(38-4)14-13-30(31,25(34)17-21)18-22(32)19-33-26(35)12-10-20-7-5-6-8-23(20)36-2/h5-12,22,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t22-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 12n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027242
PNG
(CHEMBL2113308)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33N3O6/c1-32-14-13-29-25-19-6-9-22(34)26(25)39-27(29)30(38-2)12-11-28(29,23(32)15-19)16-20(30)17-31-24(35)10-5-18-3-7-21(8-4-18)33(36)37/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,31,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 1.30n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027249
PNG
(CHEMBL2113312)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H35ClN2O3/c1-33-15-13-29-25-20-7-10-23(34)26(25)36-27(29)30(35-2)12-11-28(29,24(33)16-20)17-21(30)18-32-14-3-4-19-5-8-22(31)9-6-19/h3-10,21,24,27,32,34H,11-18H2,1-2H3/b4-3+/t21-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 14n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027244
PNG
(CHEMBL2113307)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(Cl)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H33ClN2O4/c1-33-14-13-29-25-19-6-9-22(34)26(25)37-27(29)30(36-2)12-11-28(29,23(33)15-19)16-20(30)17-32-24(35)10-5-18-3-7-21(31)8-4-18/h3-10,20,23,27,34H,11-17H2,1-2H3,(H,32,35)/b10-5+/t20-,23-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 35n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 15n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027255
PNG
(CHEMBL2113296)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1Cl)OC
Show InChI InChI=1S/C31H35ClN2O4/c1-34-15-14-30-26-20-8-10-23(36-2)27(26)38-28(30)31(37-3)13-12-29(30,24(34)16-20)17-21(31)18-33-25(35)11-9-19-6-4-5-7-22(19)32/h4-11,21,24,28H,12-18H2,1-3H3,(H,33,35)/b11-9+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 11n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50026603
PNG
(BUPRENORPHINE | Buprenorphine | CHEBI:3216)
Show SMILES CO[C@]12CC[C@@]3(C[C@@H]1[C@](C)(O)C(C)(C)C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1CC1CC1)c45
Show InChI InChI=1S/C29H41NO4/c1-25(2,3)26(4,32)20-15-27-10-11-29(20,33-5)24-28(27)12-13-30(16-17-6-7-17)21(27)14-18-8-9-19(31)23(34-24)22(18)28/h8-9,17,20-21,24,31-32H,6-7,10-16H2,1-5H3/t20-,21-,24-,26+,27-,28+,29-/m1/s1
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n/an/an/an/a>1.00E+4n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027248
PNG
(CHEMBL2113311)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC\C=C\c1ccccc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C30H36N2O3/c1-32-16-14-29-25-21-10-11-23(33)26(25)35-27(29)30(34-2)13-12-28(29,24(32)17-21)18-22(30)19-31-15-6-9-20-7-4-3-5-8-20/h3-11,22,24,27,31,33H,12-19H2,1-2H3/b9-6+/t22-,24-,27-,28-,29+,30+/m1/s1
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n/an/an/an/a 5.5n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 26n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 4n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027254
PNG
(CHEMBL2113295)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccccc1C)OC
Show InChI InChI=1S/C32H38N2O4/c1-20-7-5-6-8-21(20)10-12-26(35)33-19-23-18-30-13-14-32(23,37-4)29-31(30)15-16-34(2)25(30)17-22-9-11-24(36-3)28(38-29)27(22)31/h5-12,23,25,29H,13-19H2,1-4H3,(H,33,35)/b12-10+/t23-,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 85n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
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
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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n/an/an/an/a 16n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human mu opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027246
PNG
(CHEMBL2113313)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccccc1C)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-6-4-5-7-20(19)9-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-8-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-9+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 1.80n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027243
PNG
(CHEMBL2113306)
Show SMILES CO[C@@]12CC[C@@]3(C[C@@H]1CNC(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C31H36N2O4/c1-19-4-6-20(7-5-19)8-11-25(35)32-18-22-17-29-12-13-31(22,36-3)28-30(29)14-15-33(2)24(29)16-21-9-10-23(34)27(37-28)26(21)30/h4-11,22,24,28,34H,12-18H2,1-3H3,(H,32,35)/b11-8+/t22-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 16n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (human))
BDBM50027241
PNG
(CHEMBL2113299)
Show SMILES COc1ccc2C[C@H]3N(C)CC[C@@]45[C@@H](Oc1c24)[C@@]1(CC[C@@]35C[C@@H]1CNC(=O)\C=C\c1ccc(cc1)[N+]([O-])=O)OC
Show InChI InChI=1S/C31H35N3O6/c1-33-15-14-30-26-20-7-10-23(38-2)27(26)40-28(30)31(39-3)13-12-29(30,24(33)16-20)17-21(31)18-32-25(35)11-6-19-4-8-22(9-5-19)34(36)37/h4-11,21,24,28H,12-18H2,1-3H3,(H,32,35)/b11-6+/t21-,24-,28-,29-,30+,31+/m1/s1
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n/an/an/an/a 214n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (human))
BDBM50027247
PNG
(CHEMBL2113314)
Show SMILES CO[C@@]12C=C[C@@]3([C@@H]4CN(C[C@H]14)C(=O)\C=C\c1ccc(C)cc1)[C@H]1Cc4ccc(O)c5O[C@@H]2[C@]3(CCN1C)c45
Show InChI InChI=1S/C32H34N2O4/c1-19-4-6-20(7-5-19)8-11-26(36)34-17-22-23(18-34)32(37-3)13-12-30(22)25-16-21-9-10-24(35)28-27(21)31(30,29(32)38-28)14-15-33(25)2/h4-13,22-23,25,29,35H,14-18H2,1-3H3/b11-8+/t22-,23+,25-,29-,30-,31+,32+/m1/s1
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n/an/an/an/a 3.30n/an/an/an/a



University of Bath

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTP-gamma-S binding


J Med Chem 50: 5176-82 (2007)


Article DOI: 10.1021/jm070255o
BindingDB Entry DOI: 10.7270/Q2RR202P
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%