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Compile Data Set for Download or QSAR

Found 41 hits with Last Name = 'wachter' and Initial = 'rd'   
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


(Rattus norvegicus (rat))
BDBM50266025
PNG
((S)-2-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCC(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)30(38)34-18-23-11-7-6-10-22(23)14-27(34)29(37)33-17-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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0.0310n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266025
PNG
((S)-2-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCC(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)30(38)34-18-23-11-7-6-10-22(23)14-27(34)29(37)33-17-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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0.160n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50189920
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)29(37)33-27-14-22-10-6-7-11-23(22)17-34(30(27)38)18-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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0.460n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266060
PNG
((S)-2-amino-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28+/m0/s1
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3.35n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266063
PNG
(2-((S)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24-/m0/s1
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6.64n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266026
PNG
((S)-6-amino-2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN([C@@H](CCCCN)C(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C34H43N5O4/c1-22-16-27(40)17-23(2)28(22)19-29(36)32(41)38-30-18-25-12-6-7-13-26(25)21-39(34(30)43)31(14-8-9-15-35)33(42)37-20-24-10-4-3-5-11-24/h3-7,10-13,16-17,29-31,40H,8-9,14-15,18-21,35-36H2,1-2H3,(H,37,42)(H,38,41)/t29-,30-,31-/m0/s1
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10.1n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50189920
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)29(37)33-27-14-22-10-6-7-11-23(22)17-34(30(27)38)18-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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11n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266056
PNG
((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-((S...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C21H25N3O3/c1-12-7-16(25)8-13(2)17(12)10-18(22)20(26)24-19-9-14-5-3-4-6-15(14)11-23-21(19)27/h3-8,18-19,25H,9-11,22H2,1-2H3,(H,23,27)(H,24,26)/t18-,19-/m0/s1
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12.4n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266057
PNG
((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C23H29N3O3/c1-14-9-18(27)10-15(2)19(14)12-21(26(3)4)23(29)25-20-11-16-7-5-6-8-17(16)13-24-22(20)28/h5-10,20-21,27H,11-13H2,1-4H3,(H,24,28)(H,25,29)/t20-,21-/m0/s1
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20.5n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266058
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28-/m0/s1
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50n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266057
PNG
((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C23H29N3O3/c1-14-9-18(27)10-15(2)19(14)12-21(26(3)4)23(29)25-20-11-16-7-5-6-8-17(16)13-24-22(20)28/h5-10,20-21,27H,11-13H2,1-4H3,(H,24,28)(H,25,29)/t20-,21-/m0/s1
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64.9n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266061
PNG
((S)-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-3-oxo-1,...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C34H39N5O4/c1-21-14-24(40)15-22(2)26(21)17-31(38(3)4)33(42)37-29-16-27-25-12-8-9-13-28(25)36-30(27)19-39(34(29)43)20-32(41)35-18-23-10-6-5-7-11-23/h5-15,29,31,36,40H,16-20H2,1-4H3,(H,35,41)(H,37,42)/t29-,31+/m1/s1
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133n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266060
PNG
((S)-2-amino-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28+/m0/s1
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161n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266059
PNG
(CHEMBL501023 | benzyl 2-((S)-4-((S)-2-amino-3-(4-h...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(=O)OCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H34N4O5/c1-19-12-22(37)13-20(2)24(19)14-26(33)31(39)35-28-15-25-23-10-6-7-11-27(23)34-29(25)16-36(32(28)40)17-30(38)41-18-21-8-4-3-5-9-21/h3-13,26,28,34,37H,14-18,33H2,1-2H3,(H,35,39)/t26-,28-/m0/s1
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244n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266026
PNG
((S)-6-amino-2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN([C@@H](CCCCN)C(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C34H43N5O4/c1-22-16-27(40)17-23(2)28(22)19-29(36)32(41)38-30-18-25-12-6-7-13-26(25)21-39(34(30)43)31(14-8-9-15-35)33(42)37-20-24-10-4-3-5-11-24/h3-7,10-13,16-17,29-31,40H,8-9,14-15,18-21,35-36H2,1-2H3,(H,37,42)(H,38,41)/t29-,30-,31-/m0/s1
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290n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266058
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28-/m0/s1
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358n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266056
PNG
((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-((S...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C21H25N3O3/c1-12-7-16(25)8-13(2)17(12)10-18(22)20(26)24-19-9-14-5-3-4-6-15(14)11-23-21(19)27/h3-8,18-19,25H,9-11,22H2,1-2H3,(H,23,27)(H,24,26)/t18-,19-/m0/s1
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368n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266027
PNG
((S)-3-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN([C@@H](CC(O)=O)C(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C32H36N4O6/c1-19-12-24(37)13-20(2)25(19)15-26(33)30(40)35-27-14-22-10-6-7-11-23(22)18-36(32(27)42)28(16-29(38)39)31(41)34-17-21-8-4-3-5-9-21/h3-13,26-28,37H,14-18,33H2,1-2H3,(H,34,41)(H,35,40)(H,38,39)/t26-,27-,28-/m0/s1
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630n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266061
PNG
((S)-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-3-oxo-1,...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C34H39N5O4/c1-21-14-24(40)15-22(2)26(21)17-31(38(3)4)33(42)37-29-16-27-25-12-8-9-13-28(25)36-30(27)19-39(34(29)43)20-32(41)35-18-23-10-6-5-7-11-23/h5-15,29,31,36,40H,16-20H2,1-4H3,(H,35,41)(H,37,42)/t29-,31+/m1/s1
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681n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266089
PNG
(2-((R)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C25H28N4O5/c1-13-7-15(30)8-14(2)17(13)9-19(26)24(33)28-21-10-18-16-5-3-4-6-20(16)27-22(18)11-29(25(21)34)12-23(31)32/h3-8,19,21,27,30H,9-12,26H2,1-2H3,(H,28,33)(H,31,32)/t19-,21+/m0/s1
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720n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266062
PNG
(2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C25H28N4O5/c1-13-7-15(30)8-14(2)17(13)9-19(26)24(33)28-21-10-18-16-5-3-4-6-20(16)27-22(18)11-29(25(21)34)12-23(31)32/h3-8,19,21,27,30H,9-12,26H2,1-2H3,(H,28,33)(H,31,32)/t19-,21-/m0/s1
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806n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266063
PNG
(2-((S)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24-/m0/s1
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875n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266090
PNG
(2-((R)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24+/m1/s1
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1.15E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266062
PNG
(2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C25H28N4O5/c1-13-7-15(30)8-14(2)17(13)9-19(26)24(33)28-21-10-18-16-5-3-4-6-20(16)27-22(18)11-29(25(21)34)12-23(31)32/h3-8,19,21,27,30H,9-12,26H2,1-2H3,(H,28,33)(H,31,32)/t19-,21-/m0/s1
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1.45E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266027
PNG
((S)-3-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN([C@@H](CC(O)=O)C(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C32H36N4O6/c1-19-12-24(37)13-20(2)25(19)15-26(33)30(40)35-27-14-22-10-6-7-11-23(22)18-36(32(27)42)28(16-29(38)39)31(41)34-17-21-8-4-3-5-9-21/h3-13,26-28,37H,14-18,33H2,1-2H3,(H,34,41)(H,35,40)(H,38,39)/t26-,27-,28-/m0/s1
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1.48E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266089
PNG
(2-((R)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C25H28N4O5/c1-13-7-15(30)8-14(2)17(13)9-19(26)24(33)28-21-10-18-16-5-3-4-6-20(16)27-22(18)11-29(25(21)34)12-23(31)32/h3-8,19,21,27,30H,9-12,26H2,1-2H3,(H,28,33)(H,31,32)/t19-,21+/m0/s1
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2.90E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266059
PNG
(CHEMBL501023 | benzyl 2-((S)-4-((S)-2-amino-3-(4-h...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(=O)OCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H34N4O5/c1-19-12-22(37)13-20(2)24(19)14-26(33)31(39)35-28-15-25-23-10-6-7-11-27(23)34-29(25)16-36(32(28)40)17-30(38)41-18-21-8-4-3-5-9-21/h3-13,26,28,34,37H,14-18,33H2,1-2H3,(H,35,39)/t26-,28-/m0/s1
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4.07E+3n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50266090
PNG
(2-((R)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24+/m1/s1
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1.01E+4n/an/an/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in Sprague-Dawley rat brain synaptosomal membranes


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266025
PNG
((S)-2-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)NCC(=O)NCc1ccccc1 |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)30(38)34-18-23-11-7-6-10-22(23)14-27(34)29(37)33-17-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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n/an/a 2.69n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266060
PNG
((S)-2-amino-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28+/m0/s1
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n/an/a 14.9n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50189920
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)29(37)33-27-14-22-10-6-7-11-23(22)17-34(30(27)38)18-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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n/an/a 51n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266056
PNG
((S)-2-amino-3-(4-hydroxy-2,6-dimethylphenyl)-N-((S...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C21H25N3O3/c1-12-7-16(25)8-13(2)17(12)10-18(22)20(26)24-19-9-14-5-3-4-6-15(14)11-23-21(19)27/h3-8,18-19,25H,9-11,22H2,1-2H3,(H,23,27)(H,24,26)/t18-,19-/m0/s1
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n/an/a 631n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50189920
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN(CC(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C30H34N4O4/c1-19-12-24(35)13-20(2)25(19)15-26(31)29(37)33-27-14-22-10-6-7-11-23(22)17-34(30(27)38)18-28(36)32-16-21-8-4-3-5-9-21/h3-13,26-27,35H,14-18,31H2,1-2H3,(H,32,36)(H,33,37)/t26-,27-/m0/s1
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n/an/a 830n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse assessed as inhibition of electrically evoked vas-deferens contraction by MVD test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50266060
PNG
((S)-2-amino-N-((R)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28+/m0/s1
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n/an/a 1.50E+3n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse assessed as inhibition of electrically evoked vas-deferens contraction by MVD test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266058
PNG
((S)-2-amino-N-((S)-2-(2-(benzylamino)-2-oxoethyl)-...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(=O)NCc3ccccc3)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C32H35N5O4/c1-19-12-22(38)13-20(2)24(19)14-26(33)31(40)36-28-15-25-23-10-6-7-11-27(23)35-29(25)17-37(32(28)41)18-30(39)34-16-21-8-4-3-5-9-21/h3-13,26,28,35,38H,14-18,33H2,1-2H3,(H,34,39)(H,36,40)/t26-,28-/m0/s1
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n/an/a 1.80E+3n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266026
PNG
((S)-6-amino-2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2ccccc2CN([C@@H](CCCCN)C(=O)NCc2ccccc2)C1=O |r|
Show InChI InChI=1S/C34H43N5O4/c1-22-16-27(40)17-23(2)28(22)19-29(36)32(41)38-30-18-25-12-6-7-13-26(25)21-39(34(30)43)31(14-8-9-15-35)33(42)37-20-24-10-4-3-5-11-24/h3-7,10-13,16-17,29-31,40H,8-9,14-15,18-21,35-36H2,1-2H3,(H,37,42)(H,38,41)/t29-,30-,31-/m0/s1
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n/an/a 3.27E+3n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50266057
PNG
((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C23H29N3O3/c1-14-9-18(27)10-15(2)19(14)12-21(26(3)4)23(29)25-20-11-16-7-5-6-8-17(16)13-24-22(20)28/h5-10,20-21,27H,11-13H2,1-4H3,(H,24,28)(H,25,29)/t20-,21-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse assessed as inhibition of electrically evoked vas-deferens contraction by MVD test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266063
PNG
(2-((S)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50266063
PNG
(2-((S)-4-((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-d...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C27H32N4O5/c1-15-9-17(32)10-16(2)19(15)12-24(30(3)4)26(35)29-22-11-20-18-7-5-6-8-21(18)28-23(20)13-31(27(22)36)14-25(33)34/h5-10,22,24,28,32H,11-14H2,1-4H3,(H,29,35)(H,33,34)/t22-,24-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse assessed as inhibition of electrically evoked vas-deferens contraction by MVD test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266062
PNG
(2-((S)-4-((S)-2-amino-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N[C@H]1Cc2c(CN(CC(O)=O)C1=O)[nH]c1ccccc21 |r|
Show InChI InChI=1S/C25H28N4O5/c1-13-7-15(30)8-14(2)17(13)9-19(26)24(33)28-21-10-18-16-5-3-4-6-20(16)27-22(18)11-29(25(21)34)12-23(31)32/h3-8,19,21,27,30H,9-12,26H2,1-2H3,(H,28,33)(H,31,32)/t19-,21-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50266057
PNG
((S)-2-(dimethylamino)-3-(4-hydroxy-2,6-dimethylphe...)
Show SMILES CN(C)[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1Cc2ccccc2CNC1=O |r|
Show InChI InChI=1S/C23H29N3O3/c1-14-9-18(27)10-15(2)19(14)12-21(26(3)4)23(29)25-20-11-16-7-5-6-8-17(16)13-24-22(20)28/h5-10,20-21,27H,11-13H2,1-4H3,(H,24,28)(H,25,29)/t20-,21-/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Vrije Universiteit Brussel

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig assessed as inhibition of electrically evoked ileum contraction by GPI test


Bioorg Med Chem Lett 19: 433-7 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.051
BindingDB Entry DOI: 10.7270/Q2K64HZ7
More data for this
Ligand-Target Pair