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PubMed code 19560919

Compile data set for download or QSAR
Found 28 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
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295263
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-25(16-21-10-12-23(40)13-11-21)33(44)39-15-14-29(39)32(43)38-28(18-22-19-36-26-9-5-4-8-24(22)26)31(42)37-27(30(35)41)17-20-6-2-1-3-7-20/h1-13,19,25,27-29,36,40H,14-18,34H2,(H2,35,41)(H,37,42)(H,38,43)/t25-,27-,28-,29-/m0/s1
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 2.30n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295264
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-24(17-22-11-13-23(37)14-12-22)31(41)36-16-15-27(36)30(40)35-26(19-21-9-5-2-6-10-21)29(39)34-25(28(33)38)18-20-7-3-1-4-8-20/h1-14,24-27,37H,15-19,32H2,(H2,33,38)(H,34,39)(H,35,40)/t24-,25-,26-,27-/m0/s1
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 5.60n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295262
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC=C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,c:15|
Show InChI InChI=1S/C32H35N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-16,25-28,38H,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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 6.5n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50139013
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C32H37N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-6,8-11,13-16,25-28,38H,7,12,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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 9.56n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50095155
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C34H38N6O5/c35-26(17-22-12-14-24(41)15-13-22)34(45)40-16-6-11-30(40)33(44)39-29(19-23-20-37-27-10-5-4-9-25(23)27)32(43)38-28(31(36)42)18-21-7-2-1-3-8-21/h1-5,7-10,12-15,20,26,28-30,37,41H,6,11,16-19,35H2,(H2,36,42)(H,38,43)(H,39,44)/t26-,28-,29-,30-/m0/s1
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 10.7n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295265
PNG
(CHEMBL540482 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-26(14-21-10-12-24(40)13-11-21)33(44)39-18-23(19-39)31(42)38-29(16-22-17-36-27-9-5-4-8-25(22)27)32(43)37-28(30(35)41)15-20-6-2-1-3-7-20/h1-13,17,23,26,28-29,36,40H,14-16,18-19,34H2,(H2,35,41)(H,37,43)(H,38,42)/t26-,28-,29-/m0/s1
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 34n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295261
PNG
(CHEMBL549770 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NC(=C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C30H33N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,24-26,36H,1,16-18,31H2,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-/m0/s1
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 34n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295265
PNG
(CHEMBL540482 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-26(14-21-10-12-24(40)13-11-21)33(44)39-18-23(19-39)31(42)38-29(16-22-17-36-27-9-5-4-8-25(22)27)32(43)37-28(30(35)41)15-20-6-2-1-3-7-20/h1-13,17,23,26,28-29,36,40H,14-16,18-19,34H2,(H2,35,41)(H,37,43)(H,38,42)/t26-,28-,29-/m0/s1
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 40n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDE from delta opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295260
PNG
(CHEMBL564939 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-25(15-22-11-13-24(37)14-12-22)31(41)36-18-23(19-36)29(39)35-27(17-21-9-5-2-6-10-21)30(40)34-26(28(33)38)16-20-7-3-1-4-8-20/h1-14,23,25-27,37H,15-19,32H2,(H2,33,38)(H,34,40)(H,35,39)/t25-,26-,27-/m0/s1
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 210n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295261
PNG
(CHEMBL549770 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NC(=C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C30H33N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,24-26,36H,1,16-18,31H2,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-/m0/s1
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 710n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDE from delta opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295263
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-25(16-21-10-12-23(40)13-11-21)33(44)39-15-14-29(39)32(43)38-28(18-22-19-36-26-9-5-4-8-24(22)26)31(42)37-27(30(35)41)17-20-6-2-1-3-7-20/h1-13,19,25,27-29,36,40H,14-18,34H2,(H2,35,41)(H,37,42)(H,38,43)/t25-,27-,28-,29-/m0/s1
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 3.50E+3n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDE from delta opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295264
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-24(17-22-11-13-23(37)14-12-22)31(41)36-16-15-27(36)30(40)35-26(19-21-9-5-2-6-10-21)29(39)34-25(28(33)38)18-20-7-3-1-4-8-20/h1-14,24-27,37H,15-19,32H2,(H2,33,38)(H,34,39)(H,35,40)/t24-,25-,26-,27-/m0/s1
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 5.10E+3n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDE from delta opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50295260
PNG
(CHEMBL564939 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-25(15-22-11-13-24(37)14-12-22)31(41)36-18-23(19-36)29(39)35-27(17-21-9-5-2-6-10-21)30(40)34-26(28(33)38)16-20-7-3-1-4-8-20/h1-14,23,25-27,37H,15-19,32H2,(H2,33,38)(H,34,40)(H,35,39)/t25-,26-,27-/m0/s1
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 6.90E+3n/an/an/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDE from delta opioid receptor in rat brain membrane by liquid scintillation counting

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295264
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-24(17-22-11-13-23(37)14-12-22)31(41)36-16-15-27(36)30(40)35-26(19-21-9-5-2-6-10-21)29(39)34-25(28(33)38)18-20-7-3-1-4-8-20/h1-14,24-27,37H,15-19,32H2,(H2,33,38)(H,34,39)(H,35,40)/t24-,25-,26-,27-/m0/s1
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n/an/a 6.40E+3n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295263
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-25(16-21-10-12-23(40)13-11-21)33(44)39-15-14-29(39)32(43)38-28(18-22-19-36-26-9-5-4-8-24(22)26)31(42)37-27(30(35)41)17-20-6-2-1-3-7-20/h1-13,19,25,27-29,36,40H,14-18,34H2,(H2,35,41)(H,37,42)(H,38,43)/t25-,27-,28-,29-/m0/s1
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n/an/a 7.90E+3n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295262
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC=C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,c:15|
Show InChI InChI=1S/C32H35N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-16,25-28,38H,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50139013
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C32H37N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-6,8-11,13-16,25-28,38H,7,12,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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n/an/a 1.50E+4n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50095155
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C34H38N6O5/c35-26(17-22-12-14-24(41)15-13-22)34(45)40-16-6-11-30(40)33(44)39-29(19-23-20-37-27-10-5-4-9-25(23)27)32(43)38-28(31(36)42)18-21-7-2-1-3-8-21/h1-5,7-10,12-15,20,26,28-30,37,41H,6,11,16-19,35H2,(H2,36,42)(H,38,43)(H,39,44)/t26-,28-,29-,30-/m0/s1
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n/an/a 2.80E+4n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50295262
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC=C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r,c:15|
Show InChI InChI=1S/C32H35N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-16,25-28,38H,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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n/an/a 7.00E+4n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295265
PNG
(CHEMBL540482 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-26(14-21-10-12-24(40)13-11-21)33(44)39-18-23(19-39)31(42)38-29(16-22-17-36-27-9-5-4-8-25(22)27)32(43)37-28(30(35)41)15-20-6-2-1-3-7-20/h1-13,17,23,26,28-29,36,40H,14-16,18-19,34H2,(H2,35,41)(H,37,43)(H,38,42)/t26-,28-,29-/m0/s1
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n/an/a 1.40E+5n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50295263
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-25(16-21-10-12-23(40)13-11-21)33(44)39-15-14-29(39)32(43)38-28(18-22-19-36-26-9-5-4-8-24(22)26)31(42)37-27(30(35)41)17-20-6-2-1-3-7-20/h1-13,19,25,27-29,36,40H,14-18,34H2,(H2,35,41)(H,37,42)(H,38,43)/t25-,27-,28-,29-/m0/s1
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n/an/a 1.40E+5n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50295264
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-24(17-22-11-13-23(37)14-12-22)31(41)36-16-15-27(36)30(40)35-26(19-21-9-5-2-6-10-21)29(39)34-25(28(33)38)18-20-7-3-1-4-8-20/h1-14,24-27,37H,15-19,32H2,(H2,33,38)(H,34,39)(H,35,40)/t24-,25-,26-,27-/m0/s1
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Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50295265
PNG
(CHEMBL540482 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C33H36N6O5/c34-26(14-21-10-12-24(40)13-11-21)33(44)39-18-23(19-39)31(42)38-29(16-22-17-36-27-9-5-4-8-25(22)27)32(43)37-28(30(35)41)15-20-6-2-1-3-7-20/h1-13,17,23,26,28-29,36,40H,14-16,18-19,34H2,(H2,35,41)(H,37,43)(H,38,42)/t26-,28-,29-/m0/s1
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n/an/a 1.70E+5n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295261
PNG
(CHEMBL549770 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NC(=C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C30H33N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,24-26,36H,1,16-18,31H2,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-/m0/s1
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Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50295261
PNG
(CHEMBL549770 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)NC(=C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C30H33N5O5/c1-19(33-29(39)24(31)16-22-12-14-23(36)15-13-22)28(38)35-26(18-21-10-6-3-7-11-21)30(40)34-25(27(32)37)17-20-8-4-2-5-9-20/h2-15,24-26,36H,1,16-18,31H2,(H2,32,37)(H,33,39)(H,34,40)(H,35,38)/t24-,25-,26-/m0/s1
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n/an/a 4.90E+5n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50139013
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C32H37N5O5/c33-25(18-23-13-15-24(38)16-14-23)32(42)37-17-7-12-28(37)31(41)36-27(20-22-10-5-2-6-11-22)30(40)35-26(29(34)39)19-21-8-3-1-4-9-21/h1-6,8-11,13-16,25-28,38H,7,12,17-20,33H2,(H2,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-/m0/s1
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n/an/a 5.10E+5n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50295260
PNG
(CHEMBL564939 | N-((S)-1-((S)-1-amino-1-oxo-3-pheny...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CC(C1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C31H35N5O5/c32-25(15-22-11-13-24(37)14-12-22)31(41)36-18-23(19-36)29(39)35-27(17-21-9-5-2-6-10-21)30(40)34-26(28(33)38)16-20-7-3-1-4-8-20/h1-14,23,25-27,37H,15-19,32H2,(H2,33,38)(H,34,40)(H,35,39)/t25-,26-,27-/m0/s1
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n/an/a 1.40E+6n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50095155
PNG
((S)-1-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionyl]...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O |r|
Show InChI InChI=1S/C34H38N6O5/c35-26(17-22-12-14-24(41)15-13-22)34(45)40-16-6-11-30(40)33(44)39-29(19-23-20-37-27-10-5-4-9-25(23)27)32(43)38-28(31(36)42)18-21-7-2-1-3-8-21/h1-5,7-10,12-15,20,26,28-30,37,41H,6,11,16-19,35H2,(H2,36,42)(H,38,43)(H,39,44)/t26-,28-,29-,30-/m0/s1
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n/an/a 1.71E+6n/an/an/an/an/an/a



Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deference assessed as inhibition of electrically-stimulated contraction

Bioorg Med Chem Lett 19: 4115-8 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.008
BindingDB Entry DOI: 10.7270/Q2ZS2WJX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%