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Compile Data Set for Download or QSAR

Found 40 hits with Last Name = 'nedachi' and Initial = 'm'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199865
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)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/C36H42N6O5/c1-21-15-25(43)16-22(2)27(21)19-28(37)36(47)42-14-8-13-32(42)35(46)41-31(18-24-20-39-29-12-7-6-11-26(24)29)34(45)40-30(33(38)44)17-23-9-4-3-5-10-23/h3-7,9-12,15-16,20,28,30-32,39,43H,8,13-14,17-19,37H2,1-2H3,(H2,38,44)(H,40,45)(H,41,46)/t28-,30-,31-,32-/m0/s1
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0.0540n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199863
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C39H46N6O5/c1-4-16-41-34(22-30-24(2)18-28(46)19-25(30)3)39(50)45-17-10-15-35(45)38(49)44-33(21-27-23-42-31-14-9-8-13-29(27)31)37(48)43-32(36(40)47)20-26-11-6-5-7-12-26/h4-9,11-14,18-19,23,32-35,41-42,46H,1,10,15-17,20-22H2,2-3H3,(H2,40,47)(H,43,48)(H,44,49)/t32-,33-,34-,35-/m0/s1
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0.260n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199861
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H45N5O5/c1-4-17-39-32(23-29-24(2)19-28(43)20-25(29)3)37(47)42-18-11-16-33(42)36(46)41-31(22-27-14-9-6-10-15-27)35(45)40-30(34(38)44)21-26-12-7-5-8-13-26/h4-10,12-15,19-20,30-33,39,43H,1,11,16-18,21-23H2,2-3H3,(H2,38,44)(H,40,45)(H,41,46)/t30-,31-,32-,33-/m0/s1
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0.450n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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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0.560n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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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1.33n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199859
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1
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4.60n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199865
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)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/C36H42N6O5/c1-21-15-25(43)16-22(2)27(21)19-28(37)36(47)42-14-8-13-32(42)35(46)41-31(18-24-20-39-29-12-7-6-11-26(24)29)34(45)40-30(33(38)44)17-23-9-4-3-5-10-23/h3-7,9-12,15-16,20,28,30-32,39,43H,8,13-14,17-19,37H2,1-2H3,(H2,38,44)(H,40,45)(H,41,46)/t28-,30-,31-,32-/m0/s1
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5.60n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199867
PNG
((S)-2-allylamino-N-(5-{[(S)-2-allylamino-3-(4-hydr...)
Show SMILES CCCN(C(=O)[C@H](Cc1c(C)cc(O)cc1C)NCC=C)c1cnc(N(CCC)C(=O)[C@H](Cc2c(C)cc(O)cc2C)NCC=C)c(=O)[nH]1
Show InChI InChI=1S/C38H52N6O5/c1-9-13-39-32(21-30-24(5)17-28(45)18-25(30)6)37(48)43(15-11-3)34-23-41-35(36(47)42-34)44(16-12-4)38(49)33(40-14-10-2)22-31-26(7)19-29(46)20-27(31)8/h9-10,17-20,23,32-33,39-40,45-46H,1-2,11-16,21-22H2,3-8H3,(H,42,47)/t32-,33-/m0/s1
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6.94n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199863
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C39H46N6O5/c1-4-16-41-34(22-30-24(2)18-28(46)19-25(30)3)39(50)45-17-10-15-35(45)38(49)44-33(21-27-23-42-31-14-9-8-13-29(27)31)37(48)43-32(36(40)47)20-26-11-6-5-7-12-26/h4-9,11-14,18-19,23,32-35,41-42,46H,1,10,15-17,20-22H2,2-3H3,(H2,40,47)(H,43,48)(H,44,49)/t32-,33-,34-,35-/m0/s1
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10.3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199862
PNG
((S)-2-allylamino-N-{6-[(S)-2-allylamino-3-(4-hydro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)NCCCCCCNC(=O)[C@H](Cc2ccc(O)cc2)NCC=C)cc1
Show InChI InChI=1S/C30H42N4O4/c1-3-17-31-27(21-23-9-13-25(35)14-10-23)29(37)33-19-7-5-6-8-20-34-30(38)28(32-18-4-2)22-24-11-15-26(36)16-12-24/h3-4,9-16,27-28,31-32,35-36H,1-2,5-8,17-22H2,(H,33,37)(H,34,38)/t27-,28-/m0/s1
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12.4n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199864
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C40H49N5O5/c1-5-19-41-35(26-32-27(3)22-31(46)23-28(32)4)40(50)45-21-13-18-36(45)39(49)44-34(25-30-16-11-8-12-17-30)38(48)43-33(37(47)42-20-6-2)24-29-14-9-7-10-15-29/h5-12,14-17,22-23,33-36,41,46H,1-2,13,18-21,24-26H2,3-4H3,(H,42,47)(H,43,48)(H,44,49)/t33-,34-,35-,36-/m0/s1
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13.1n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199862
PNG
((S)-2-allylamino-N-{6-[(S)-2-allylamino-3-(4-hydro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)NCCCCCCNC(=O)[C@H](Cc2ccc(O)cc2)NCC=C)cc1
Show InChI InChI=1S/C30H42N4O4/c1-3-17-31-27(21-23-9-13-25(35)14-10-23)29(37)33-19-7-5-6-8-20-34-30(38)28(32-18-4-2)22-24-11-15-26(36)16-12-24/h3-4,9-16,27-28,31-32,35-36H,1-2,5-8,17-22H2,(H,33,37)(H,34,38)/t27-,28-/m0/s1
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51.5n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199867
PNG
((S)-2-allylamino-N-(5-{[(S)-2-allylamino-3-(4-hydr...)
Show SMILES CCCN(C(=O)[C@H](Cc1c(C)cc(O)cc1C)NCC=C)c1cnc(N(CCC)C(=O)[C@H](Cc2c(C)cc(O)cc2C)NCC=C)c(=O)[nH]1
Show InChI InChI=1S/C38H52N6O5/c1-9-13-39-32(21-30-24(5)17-28(45)18-25(30)6)37(48)43(15-11-3)34-23-41-35(36(47)42-34)44(16-12-4)38(49)33(40-14-10-2)22-31-26(7)19-29(46)20-27(31)8/h9-10,17-20,23,32-33,39-40,45-46H,1-2,11-16,21-22H2,3-8H3,(H,42,47)/t32-,33-/m0/s1
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77.8n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199860
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxyphenyl)propa...)
Show SMILES NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NCC=C
Show InChI InChI=1S/C35H41N5O5/c1-2-19-37-30(23-26-15-17-27(41)18-16-26)35(45)40-20-9-14-31(40)34(44)39-29(22-25-12-7-4-8-13-25)33(43)38-28(32(36)42)21-24-10-5-3-6-11-24/h2-8,10-13,15-18,28-31,37,41H,1,9,14,19-23H2,(H2,36,42)(H,38,43)(H,39,44)/t28-,29-,30-,31-/m0/s1
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130n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199859
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1
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217n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199861
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H45N5O5/c1-4-17-39-32(23-29-24(2)19-28(43)20-25(29)3)37(47)42-18-11-16-33(42)36(46)41-31(22-27-14-9-6-10-15-27)35(45)40-30(34(38)44)21-26-12-7-5-8-13-26/h4-10,12-15,19-20,30-33,39,43H,1,11,16-18,21-23H2,2-3H3,(H2,38,44)(H,40,45)(H,41,46)/t30-,31-,32-,33-/m0/s1
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560n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199866
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCC=C)cc1
Show InChI InChI=1S/C38H45N5O5/c1-3-21-39-33(26-29-17-19-30(44)20-18-29)38(48)43-23-11-16-34(43)37(47)42-32(25-28-14-9-6-10-15-28)36(46)41-31(35(45)40-22-4-2)24-27-12-7-5-8-13-27/h3-10,12-15,17-20,31-34,39,44H,1-2,11,16,21-26H2,(H,40,45)(H,41,46)(H,42,47)/t31-,32-,33-,34-/m0/s1
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1.05E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199864
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C40H49N5O5/c1-5-19-41-35(26-32-27(3)22-31(46)23-28(32)4)40(50)45-21-13-18-36(45)39(49)44-34(25-30-16-11-8-12-17-30)38(48)43-33(37(47)42-20-6-2)24-29-14-9-7-10-15-29/h5-12,14-17,22-23,33-36,41,46H,1-2,13,18-21,24-26H2,3-4H3,(H,42,47)(H,43,48)(H,44,49)/t33-,34-,35-,36-/m0/s1
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1.42E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-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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1.75E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199866
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)N2CCC[C@H]2C(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](Cc2ccccc2)C(=O)NCC=C)cc1
Show InChI InChI=1S/C38H45N5O5/c1-3-21-39-33(26-29-17-19-30(44)20-18-29)38(48)43-23-11-16-34(43)37(47)42-32(25-28-14-9-6-10-15-28)36(46)41-31(35(45)40-22-4-2)24-27-12-7-5-8-13-27/h3-10,12-15,17-20,31-34,39,44H,1-2,11,16,21-26H2,(H,40,45)(H,41,46)(H,42,47)/t31-,32-,33-,34-/m0/s1
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5.76E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-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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6.08E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50199860
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxyphenyl)propa...)
Show SMILES NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NCC=C
Show InChI InChI=1S/C35H41N5O5/c1-2-19-37-30(23-26-15-17-27(41)18-16-26)35(45)40-20-9-14-31(40)34(44)39-29(22-25-12-7-4-8-13-25)33(43)38-28(32(36)42)21-24-10-5-3-6-11-24/h2-8,10-13,15-18,28-31,37,41H,1,9,14,19-23H2,(H2,36,42)(H,38,43)(H,39,44)/t28-,29-,30-,31-/m0/s1
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7.36E+3n/an/an/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Displacement of [3H]deltorphin 2 from delta opioid receptor in rat brain P2 synaptosome


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199865
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)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/C36H42N6O5/c1-21-15-25(43)16-22(2)27(21)19-28(37)36(47)42-14-8-13-32(42)35(46)41-31(18-24-20-39-29-12-7-6-11-26(24)29)34(45)40-30(33(38)44)17-23-9-4-3-5-10-23/h3-7,9-12,15-16,20,28,30-32,39,43H,8,13-14,17-19,37H2,1-2H3,(H2,38,44)(H,40,45)(H,41,46)/t28-,30-,31-,32-/m0/s1
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n/an/a 0.270n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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 4.03n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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 6.88n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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 283n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
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 344n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199859
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199867
PNG
((S)-2-allylamino-N-(5-{[(S)-2-allylamino-3-(4-hydr...)
Show SMILES CCCN(C(=O)[C@H](Cc1c(C)cc(O)cc1C)NCC=C)c1cnc(N(CCC)C(=O)[C@H](Cc2c(C)cc(O)cc2C)NCC=C)c(=O)[nH]1
Show InChI InChI=1S/C38H52N6O5/c1-9-13-39-32(21-30-24(5)17-28(45)18-25(30)6)37(48)43(15-11-3)34-23-41-35(36(47)42-34)44(16-12-4)38(49)33(40-14-10-2)22-31-26(7)19-29(46)20-27(31)8/h9-10,17-20,23,32-33,39-40,45-46H,1-2,11-16,21-22H2,3-8H3,(H,42,47)/t32-,33-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199862
PNG
((S)-2-allylamino-N-{6-[(S)-2-allylamino-3-(4-hydro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)NCCCCCCNC(=O)[C@H](Cc2ccc(O)cc2)NCC=C)cc1
Show InChI InChI=1S/C30H42N4O4/c1-3-17-31-27(21-23-9-13-25(35)14-10-23)29(37)33-19-7-5-6-8-20-34-30(38)28(32-18-4-2)22-24-11-15-26(36)16-12-24/h3-4,9-16,27-28,31-32,35-36H,1-2,5-8,17-22H2,(H,33,37)(H,34,38)/t27-,28-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199861
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H45N5O5/c1-4-17-39-32(23-29-24(2)19-28(43)20-25(29)3)37(47)42-18-11-16-33(42)36(46)41-31(22-27-14-9-6-10-15-27)35(45)40-30(34(38)44)21-26-12-7-5-8-13-26/h4-10,12-15,19-20,30-33,39,43H,1,11,16-18,21-23H2,2-3H3,(H2,38,44)(H,40,45)(H,41,46)/t30-,31-,32-,33-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199867
PNG
((S)-2-allylamino-N-(5-{[(S)-2-allylamino-3-(4-hydr...)
Show SMILES CCCN(C(=O)[C@H](Cc1c(C)cc(O)cc1C)NCC=C)c1cnc(N(CCC)C(=O)[C@H](Cc2c(C)cc(O)cc2C)NCC=C)c(=O)[nH]1
Show InChI InChI=1S/C38H52N6O5/c1-9-13-39-32(21-30-24(5)17-28(45)18-25(30)6)37(48)43(15-11-3)34-23-41-35(36(47)42-34)44(16-12-4)38(49)33(40-14-10-2)22-31-26(7)19-29(46)20-27(31)8/h9-10,17-20,23,32-33,39-40,45-46H,1-2,11-16,21-22H2,3-8H3,(H,42,47)/t32-,33-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199864
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C40H49N5O5/c1-5-19-41-35(26-32-27(3)22-31(46)23-28(32)4)40(50)45-21-13-18-36(45)39(49)44-34(25-30-16-11-8-12-17-30)38(48)43-33(37(47)42-20-6-2)24-29-14-9-7-10-15-29/h5-12,14-17,22-23,33-36,41,46H,1-2,13,18-21,24-26H2,3-4H3,(H,42,47)(H,43,48)(H,44,49)/t33-,34-,35-,36-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199862
PNG
((S)-2-allylamino-N-{6-[(S)-2-allylamino-3-(4-hydro...)
Show SMILES Oc1ccc(C[C@H](NCC=C)C(=O)NCCCCCCNC(=O)[C@H](Cc2ccc(O)cc2)NCC=C)cc1
Show InChI InChI=1S/C30H42N4O4/c1-3-17-31-27(21-23-9-13-25(35)14-10-23)29(37)33-19-7-5-6-8-20-34-30(38)28(32-18-4-2)22-24-11-15-26(36)16-12-24/h3-4,9-16,27-28,31-32,35-36H,1-2,5-8,17-22H2,(H,33,37)(H,34,38)/t27-,28-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199863
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C39H46N6O5/c1-4-16-41-34(22-30-24(2)18-28(46)19-25(30)3)39(50)45-17-10-15-35(45)38(49)44-33(21-27-23-42-31-14-9-8-13-29(27)31)37(48)43-32(36(40)47)20-26-11-6-5-7-12-26/h4-9,11-14,18-19,23,32-35,41-42,46H,1,10,15-17,20-22H2,2-3H3,(H2,40,47)(H,43,48)(H,44,49)/t32-,33-,34-,35-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199865
PNG
((S)-N-((S)-1-((S)-1-amino-1-oxo-3-phenylpropan-2-y...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)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/C36H42N6O5/c1-21-15-25(43)16-22(2)27(21)19-28(37)36(47)42-14-8-13-32(42)35(46)41-31(18-24-20-39-29-12-7-6-11-26(24)29)34(45)40-30(33(38)44)17-23-9-4-3-5-10-23/h3-7,9-12,15-16,20,28,30-32,39,43H,8,13-14,17-19,37H2,1-2H3,(H2,38,44)(H,40,45)(H,41,46)/t28-,30-,31-,32-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(GUINEA PIG)
BDBM50199863
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C39H46N6O5/c1-4-16-41-34(22-30-24(2)18-28(46)19-25(30)3)39(50)45-17-10-15-35(45)38(49)44-33(21-27-23-42-31-14-9-8-13-29(27)31)37(48)43-32(36(40)47)20-26-11-6-5-7-12-26/h4-9,11-14,18-19,23,32-35,41-42,46H,1,10,15-17,20-22H2,2-3H3,(H2,40,47)(H,43,48)(H,44,49)/t32-,33-,34-,35-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at mu opioid receptor in Hartley guinea pig intestine assessed as inhibition of electrically evoked myenteric plexus longitudinal mu...


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199859
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C42H50N6O5/c1-5-18-43-37(25-33-27(3)21-31(49)22-28(33)4)42(53)48-20-12-17-38(48)41(52)47-36(24-30-26-45-34-16-11-10-15-32(30)34)40(51)46-35(39(50)44-19-6-2)23-29-13-8-7-9-14-29/h5-11,13-16,21-22,26,35-38,43,45,49H,1-2,12,17-20,23-25H2,3-4H3,(H,44,50)(H,46,51)(H,47,52)/t35-,36-,37-,38-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199861
PNG
((S)-1-((S)-2-(allylamino)-3-(4-hydroxy-2,6-dimethy...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O
Show InChI InChI=1S/C37H45N5O5/c1-4-17-39-32(23-29-24(2)19-28(43)20-25(29)3)37(47)42-18-11-16-33(42)36(46)41-31(22-27-14-9-6-10-15-27)35(45)40-30(34(38)44)21-26-12-7-5-8-13-26/h4-10,12-15,19-20,30-33,39,43H,1,11,16-18,21-23H2,2-3H3,(H2,38,44)(H,40,45)(H,41,46)/t30-,31-,32-,33-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50199864
PNG
((S)-N-((S)-1-((S)-1-(allylamino)-1-oxo-3-phenylpro...)
Show SMILES Cc1cc(O)cc(C)c1C[C@H](NCC=C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC=C
Show InChI InChI=1S/C40H49N5O5/c1-5-19-41-35(26-32-27(3)22-31(46)23-28(32)4)40(50)45-21-13-18-36(45)39(49)44-34(25-30-16-11-8-12-17-30)38(48)43-33(37(47)42-20-6-2)24-29-14-9-7-10-15-29/h5-12,14-17,22-23,33-36,41,46H,1-2,13,18-21,24-26H2,3-4H3,(H,42,47)(H,43,48)(H,44,49)/t33-,34-,35-,36-/m0/s1
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n/an/a>1.00E+4n/an/an/an/an/an/a



Kobe Gakuin University

Curated by ChEMBL


Assay Description
Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically evoked muscle contractions


Bioorg Med Chem 15: 1237-51 (2007)


Article DOI: 10.1016/j.bmc.2006.11.019
BindingDB Entry DOI: 10.7270/Q2348K1F
More data for this
Ligand-Target Pair