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PubMed code 25129170

Compile data set for download or QSAR
Found 20 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))		BDBM50012477
PNG
(1-Phenethyl-4-(phenyl-propionyl-amino)-piperidine-...)
Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccccc2)CC1)C(=O)OC
Show InChI InChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
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 0.0240n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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 1.5n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50012477
PNG
(1-Phenethyl-4-(phenyl-propionyl-amino)-piperidine-...)
Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccccc2)CC1)C(=O)OC
Show InChI InChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
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 3.30n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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 28n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50012477
PNG
(1-Phenethyl-4-(phenyl-propionyl-amino)-piperidine-...)
Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccccc2)CC1)C(=O)OC
Show InChI InChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
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 43n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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 83n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50100634
PNG
(CHEMBL3325854)
Show SMILES CCC(=O)N(c1ccccc1)[C@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:14.15,wD:11.11,(37.75,-3.12,;38.53,-4.44,;37.77,-5.79,;36.23,-5.8,;38.56,-7.11,;40.1,-7.1,;40.87,-8.43,;42.41,-8.41,;43.17,-7.07,;42.38,-5.74,;40.84,-5.76,;37.8,-8.46,;37.02,-7.13,;35.48,-7.12,;34.72,-8.45,;33.18,-8.45,;32.41,-7.11,;30.87,-7.11,;30.11,-5.77,;28.57,-5.77,;27.8,-7.11,;28.57,-8.44,;30.11,-8.44,;35.48,-9.78,;37.02,-9.78,;38.58,-9.79,;37.82,-11.13,;40.12,-9.78,;40.89,-11.1,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25-
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 95n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50100634
PNG
(CHEMBL3325854)
Show SMILES CCC(=O)N(c1ccccc1)[C@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:14.15,wD:11.11,(37.75,-3.12,;38.53,-4.44,;37.77,-5.79,;36.23,-5.8,;38.56,-7.11,;40.1,-7.1,;40.87,-8.43,;42.41,-8.41,;43.17,-7.07,;42.38,-5.74,;40.84,-5.76,;37.8,-8.46,;37.02,-7.13,;35.48,-7.12,;34.72,-8.45,;33.18,-8.45,;32.41,-7.11,;30.87,-7.11,;30.11,-5.77,;28.57,-5.77,;27.8,-7.11,;28.57,-8.44,;30.11,-8.44,;35.48,-9.78,;37.02,-9.78,;38.58,-9.79,;37.82,-11.13,;40.12,-9.78,;40.89,-11.1,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25-
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 110n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50314879
PNG
(CHEMBL1091995 | N-formylnormorphine)
Show SMILES O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C=O)c45 |r,c:2|
Show InChI InChI=1S/C17H17NO4/c19-8-18-6-5-17-10-2-4-13(21)16(17)22-15-12(20)3-1-9(14(15)17)7-11(10)18/h1-4,8,10-11,13,16,20-21H,5-7H2/t10-,11+,13-,16-,17-/m0/s1
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 363n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50314879
PNG
(CHEMBL1091995 | N-formylnormorphine)
Show SMILES O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C=O)c45 |r,c:2|
Show InChI InChI=1S/C17H17NO4/c19-8-18-6-5-17-10-2-4-13(21)16(17)22-15-12(20)3-1-9(14(15)17)7-11(10)18/h1-4,8,10-11,13,16,20-21H,5-7H2/t10-,11+,13-,16-,17-/m0/s1
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 420n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))		BDBM50100635
PNG
(CHEMBL3325853)
Show SMILES CCC(=O)N(c1ccccc1)[C@@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:11.11,14.15,(14.14,-1.66,;14.92,-2.99,;14.16,-4.33,;12.62,-4.35,;14.95,-5.66,;16.49,-5.64,;17.26,-6.97,;18.8,-6.96,;19.56,-5.61,;18.77,-4.28,;17.23,-4.31,;14.19,-7.01,;13.41,-5.67,;11.87,-5.67,;11.11,-7,;9.57,-6.99,;8.8,-5.66,;7.26,-5.66,;6.5,-4.32,;4.96,-4.32,;4.19,-5.65,;4.96,-6.99,;6.5,-6.99,;11.87,-8.33,;13.41,-8.33,;14.96,-8.33,;14.2,-9.67,;16.5,-8.32,;17.28,-9.64,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25+
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>5.00E+3n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50100635
PNG
(CHEMBL3325853)
Show SMILES CCC(=O)N(c1ccccc1)[C@@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:11.11,14.15,(14.14,-1.66,;14.92,-2.99,;14.16,-4.33,;12.62,-4.35,;14.95,-5.66,;16.49,-5.64,;17.26,-6.97,;18.8,-6.96,;19.56,-5.61,;18.77,-4.28,;17.23,-4.31,;14.19,-7.01,;13.41,-5.67,;11.87,-5.67,;11.11,-7,;9.57,-6.99,;8.8,-5.66,;7.26,-5.66,;6.5,-4.32,;4.96,-4.32,;4.19,-5.65,;4.96,-6.99,;6.5,-6.99,;11.87,-8.33,;13.41,-8.33,;14.96,-8.33,;14.2,-9.67,;16.5,-8.32,;17.28,-9.64,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25+
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>5.00E+3n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50100635
PNG
(CHEMBL3325853)
Show SMILES CCC(=O)N(c1ccccc1)[C@@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:11.11,14.15,(14.14,-1.66,;14.92,-2.99,;14.16,-4.33,;12.62,-4.35,;14.95,-5.66,;16.49,-5.64,;17.26,-6.97,;18.8,-6.96,;19.56,-5.61,;18.77,-4.28,;17.23,-4.31,;14.19,-7.01,;13.41,-5.67,;11.87,-5.67,;11.11,-7,;9.57,-6.99,;8.8,-5.66,;7.26,-5.66,;6.5,-4.32,;4.96,-4.32,;4.19,-5.65,;4.96,-6.99,;6.5,-6.99,;11.87,-8.33,;13.41,-8.33,;14.96,-8.33,;14.2,-9.67,;16.5,-8.32,;17.28,-9.64,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25+
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>5.00E+3n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))		BDBM50100634
PNG
(CHEMBL3325854)
Show SMILES CCC(=O)N(c1ccccc1)[C@]1(CC[C@H](CCc2ccccc2)CC1)C(=O)OC |r,wU:14.15,wD:11.11,(37.75,-3.12,;38.53,-4.44,;37.77,-5.79,;36.23,-5.8,;38.56,-7.11,;40.1,-7.1,;40.87,-8.43,;42.41,-8.41,;43.17,-7.07,;42.38,-5.74,;40.84,-5.76,;37.8,-8.46,;37.02,-7.13,;35.48,-7.12,;34.72,-8.45,;33.18,-8.45,;32.41,-7.11,;30.87,-7.11,;30.11,-5.77,;28.57,-5.77,;27.8,-7.11,;28.57,-8.44,;30.11,-8.44,;35.48,-9.78,;37.02,-9.78,;38.58,-9.79,;37.82,-11.13,;40.12,-9.78,;40.89,-11.1,)|
Show InChI InChI=1S/C25H31NO3/c1-3-23(27)26(22-12-8-5-9-13-22)25(24(28)29-2)18-16-21(17-19-25)15-14-20-10-6-4-7-11-20/h4-13,21H,3,14-19H2,1-2H3/t21-,25-
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>5.00E+3n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))		BDBM50314879
PNG
(CHEMBL1091995 | N-formylnormorphine)
Show SMILES O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C=O)c45 |r,c:2|
Show InChI InChI=1S/C17H17NO4/c19-8-18-6-5-17-10-2-4-13(21)16(17)22-15-12(20)3-1-9(14(15)17)7-11(10)18/h1-4,8,10-11,13,16,20-21H,5-7H2/t10-,11+,13-,16-,17-/m0/s1
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 1.77E+4n/an/an/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membranes

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50012477
PNG
(1-Phenethyl-4-(phenyl-propionyl-amino)-piperidine-...)
Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccccc2)CC1)C(=O)OC
Show InChI InChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
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n/an/a 0.0190n/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50012477
PNG
(1-Phenethyl-4-(phenyl-propionyl-amino)-piperidine-...)
Show SMILES CCC(=O)N(c1ccccc1)C1(CCN(CCc2ccccc2)CC1)C(=O)OC
Show InChI InChI=1S/C24H30N2O3/c1-3-22(27)26(21-12-8-5-9-13-21)24(23(28)29-2)15-18-25(19-16-24)17-14-20-10-6-4-7-11-20/h4-13H,3,14-19H2,1-2H3
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n/an/a 17n/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)		BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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n/an/a 29n/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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n/an/a 155n/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)		BDBM50314879
PNG
(CHEMBL1091995 | N-formylnormorphine)
Show SMILES O[C@H]1C=C[C@H]2[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3C=O)c45 |r,c:2|
Show InChI InChI=1S/C17H17NO4/c19-8-18-6-5-17-10-2-4-13(21)16(17)22-15-12(20)3-1-9(14(15)17)7-11(10)18/h1-4,8,10-11,13,16,20-21H,5-7H2/t10-,11+,13-,16-,17-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Clinical Research Institute of Montreal

Curated by ChEMBL


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

Bioorg Med Chem 22: 4581-6 (2014)


Article DOI: 10.1016/j.bmc.2014.07.033
BindingDB Entry DOI: 10.7270/Q2P270WT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%