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Compile Data Set for Download or QSAR

Found 337 hits with Last Name = 'yamakawa' and Initial = 't'   
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


(MOUSE)
BDBM50253136
PNG
(CHEMBL4075409)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC=C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H30N2O3/c1-2-13-29-14-12-27-21-16-20(31)9-8-19(21)15-24(29)28(27)11-10-22-25(27)23(33-28)17-30(22)26(32)18-6-4-3-5-7-18/h2-9,16,22-25,31H,1,10-15,17H2/t22?,23-,24?,25?,27?,28?/m1/s1
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0.109n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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0.154n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human delta opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254132
PNG
(CHEMBL4083940)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O2/c33-23-9-8-21-14-26-29-11-10-25-27(22(16-29)18-32(25)28(34)20-4-2-1-3-5-20)30(29,24(21)15-23)12-13-31(26)17-19-6-7-19/h1-5,8-9,15,19,22,25-27,33H,6-7,10-14,16-18H2/t22-,25?,26?,27?,29?,30?/m1/s1
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0.211n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50253140
PNG
(CHEMBL4081856)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)S(=O)(=O)c1ccccc1 |r,TLB:16:17:21.20.19:7,3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H32N2O4S/c31-20-9-8-19-14-25-28-11-10-23-26(27(28,22(19)15-20)12-13-29(25)16-18-6-7-18)24(34-28)17-30(23)35(32,33)21-4-2-1-3-5-21/h1-5,8-9,15,18,23-26,31H,6-7,10-14,16-17H2/t23?,24-,25?,26?,27?,28?/m1/s1
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0.221n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human delta opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254124
PNG
(CHEMBL4103044)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccoc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C28H32N2O3/c31-21-4-3-18-11-24-27-7-5-23-25(20(13-27)15-30(23)26(32)19-6-10-33-16-19)28(27,22(18)12-21)8-9-29(24)14-17-1-2-17/h3-4,6,10,12,16-17,20,23-25,31H,1-2,5,7-9,11,13-15H2/t20-,23?,24?,25?,27?,28?/m1/s1
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0.221n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254133
PNG
(CHEMBL4076632)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Nc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H35N3O2/c34-23-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-23)12-13-32(26)17-19-6-7-19)21(16-29)18-33(25)28(35)31-22-4-2-1-3-5-22/h1-5,8-9,15,19,21,25-27,34H,6-7,10-14,16-18H2,(H,31,35)/t21-,25?,26?,27?,29?,30?/m1/s1
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0.265n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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0.274n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50253138
PNG
(CHEMBL4076303)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1
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0.301n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50253140
PNG
(CHEMBL4081856)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)S(=O)(=O)c1ccccc1 |r,TLB:16:17:21.20.19:7,3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H32N2O4S/c31-20-9-8-19-14-25-28-11-10-23-26(27(28,22(19)15-20)12-13-29(25)16-18-6-7-18)24(34-28)17-30(23)35(32,33)21-4-2-1-3-5-21/h1-5,8-9,15,18,23-26,31H,6-7,10-14,16-17H2/t23?,24-,25?,26?,27?,28?/m1/s1
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0.308n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254124
PNG
(CHEMBL4103044)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccoc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C28H32N2O3/c31-21-4-3-18-11-24-27-7-5-23-25(20(13-27)15-30(23)26(32)19-6-10-33-16-19)28(27,22(18)12-21)8-9-29(24)14-17-1-2-17/h3-4,6,10,12,16-17,20,23-25,31H,1-2,5,7-9,11,13-15H2/t20-,23?,24?,25?,27?,28?/m1/s1
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0.313n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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0.325n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254133
PNG
(CHEMBL4076632)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Nc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H35N3O2/c34-23-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-23)12-13-32(26)17-19-6-7-19)21(16-29)18-33(25)28(35)31-22-4-2-1-3-5-22/h1-5,8-9,15,19,21,25-27,34H,6-7,10-14,16-18H2,(H,31,35)/t21-,25?,26?,27?,29?,30?/m1/s1
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0.336n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254131
PNG
(CHEMBL4094845)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1cnccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C27H32N4O/c32-20-4-3-18-11-23-26-6-5-22-25(19(13-26)16-31(22)24-14-28-8-9-29-24)27(26,21(18)12-20)7-10-30(23)15-17-1-2-17/h3-4,8-9,12,14,17,19,22-23,25,32H,1-2,5-7,10-11,13,15-16H2/t19-,22?,23?,25?,26?,27?/m1/s1
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0.356n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254132
PNG
(CHEMBL4083940)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O2/c33-23-9-8-21-14-26-29-11-10-25-27(22(16-29)18-32(25)28(34)20-4-2-1-3-5-20)30(29,24(21)15-23)12-13-31(26)17-19-6-7-19/h1-5,8-9,15,19,22,25-27,33H,6-7,10-14,16-18H2/t22-,25?,26?,27?,29?,30?/m1/s1
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0.362n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50253137
PNG
(CHEMBL4076673)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CCCOC)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H34N2O4/c1-34-15-5-13-30-14-12-28-22-17-21(32)9-8-20(22)16-25(30)29(28)11-10-23-26(28)24(35-29)18-31(23)27(33)19-6-3-2-4-7-19/h2-4,6-9,17,23-26,32H,5,10-16,18H2,1H3/t23?,24-,25?,26?,28?,29?/m1/s1
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0.368n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253138
PNG
(CHEMBL4076303)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C26H28N2O3/c1-27-12-11-25-19-14-18(29)8-7-17(19)13-22(27)26(25)10-9-20-23(25)21(31-26)15-28(20)24(30)16-5-3-2-4-6-16/h2-8,14,20-23,29H,9-13,15H2,1H3/t20?,21-,22?,23?,25?,26?/m1/s1
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0.383n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254124
PNG
(CHEMBL4103044)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccoc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C28H32N2O3/c31-21-4-3-18-11-24-27-7-5-23-25(20(13-27)15-30(23)26(32)19-6-10-33-16-19)28(27,22(18)12-21)8-9-29(24)14-17-1-2-17/h3-4,6,10,12,16-17,20,23-25,31H,1-2,5,7-9,11,13-15H2/t20-,23?,24?,25?,27?,28?/m1/s1
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0.455n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254123
PNG
(CHEMBL4068691)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H33N3O2/c33-21-7-6-19-13-25-28-9-8-24-26(20(15-28)17-32(24)27(34)23-3-1-2-11-30-23)29(28,22(19)14-21)10-12-31(25)16-18-4-5-18/h1-3,6-7,11,14,18,20,24-26,33H,4-5,8-10,12-13,15-17H2/t20-,24?,25?,26?,28?,29?/m1/s1
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0.458n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50253139
PNG
(CHEMBL4096314)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CCc1ccccc1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C33H34N2O3/c36-25-12-11-24-19-29-33-15-13-27-30(28(38-33)21-35(27)31(37)23-9-5-2-6-10-23)32(33,26(24)20-25)16-18-34(29)17-14-22-7-3-1-4-8-22/h1-12,20,27-30,36H,13-19,21H2/t27?,28-,29?,30?,32?,33?/m1/s1
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0.458n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254131
PNG
(CHEMBL4094845)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1cnccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C27H32N4O/c32-20-4-3-18-11-23-26-6-5-22-25(19(13-26)16-31(22)24-14-28-8-9-29-24)27(26,21(18)12-20)7-10-30(23)15-17-1-2-17/h3-4,8-9,12,14,17,19,22-23,25,32H,1-2,5-7,10-11,13,15-16H2/t19-,22?,23?,25?,26?,27?/m1/s1
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0.479n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50253158
PNG
(CHEMBL4100943)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:3:11:25:15.1,2:1:25:12.13.11,13:14:28.27.26:17.24.18,24:25:15.1:12.13.11,29:28:14:17.24.18,23:24:28.27.26:14,THB:26:25:15.1:12.13.11|
Show InChI InChI=1S/C29H34N2O2/c32-22-9-8-21-14-26-29-11-10-24-27(25(33-29)18-31(24)17-19-4-2-1-3-5-19)28(29,23(21)15-22)12-13-30(26)16-20-6-7-20/h1-5,8-9,15,20,24-27,32H,6-7,10-14,16-18H2/t24?,25-,26?,27?,28?,29?/m1/s1
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0.501n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human delta opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254120
PNG
(CHEMBL4076681)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Oc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O3/c33-22-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-22)12-13-31(26)17-19-6-7-19)21(16-29)18-32(25)28(34)35-23-4-2-1-3-5-23/h1-5,8-9,15,19,21,25-27,33H,6-7,10-14,16-18H2/t21-,25?,26?,27?,29?,30?/m1/s1
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0.522n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254133
PNG
(CHEMBL4076632)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Nc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H35N3O2/c34-23-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-23)12-13-32(26)17-19-6-7-19)21(16-29)18-33(25)28(35)31-22-4-2-1-3-5-22/h1-5,8-9,15,19,21,25-27,34H,6-7,10-14,16-18H2,(H,31,35)/t21-,25?,26?,27?,29?,30?/m1/s1
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0.545n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253139
PNG
(CHEMBL4096314)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CCc1ccccc1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C33H34N2O3/c36-25-12-11-24-19-29-33-15-13-27-30(28(38-33)21-35(27)31(37)23-9-5-2-6-10-23)32(33,26(24)20-25)16-18-34(29)17-14-22-7-3-1-4-8-22/h1-12,20,27-30,36H,13-19,21H2/t27?,28-,29?,30?,32?,33?/m1/s1
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0.548n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254123
PNG
(CHEMBL4068691)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H33N3O2/c33-21-7-6-19-13-25-28-9-8-24-26(20(15-28)17-32(24)27(34)23-3-1-2-11-30-23)29(28,22(19)14-21)10-12-31(25)16-18-4-5-18/h1-3,6-7,11,14,18,20,24-26,33H,4-5,8-10,12-13,15-17H2/t20-,24?,25?,26?,28?,29?/m1/s1
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0.564n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254132
PNG
(CHEMBL4083940)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O2/c33-23-9-8-21-14-26-29-11-10-25-27(22(16-29)18-32(25)28(34)20-4-2-1-3-5-20)30(29,24(21)15-23)12-13-31(26)17-19-6-7-19/h1-5,8-9,15,19,22,25-27,33H,6-7,10-14,16-18H2/t22-,25?,26?,27?,29?,30?/m1/s1
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0.578n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254130
PNG
(CHEMBL4061334)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H36N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h1-5,8-9,15,21,23,26-28,33H,6-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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0.585n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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0.627n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50253140
PNG
(CHEMBL4081856)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)S(=O)(=O)c1ccccc1 |r,TLB:16:17:21.20.19:7,3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H32N2O4S/c31-20-9-8-19-14-25-28-11-10-23-26(27(28,22(19)15-20)12-13-29(25)16-18-6-7-18)24(34-28)17-30(23)35(32,33)21-4-2-1-3-5-21/h1-5,8-9,15,18,23-26,31H,6-7,10-14,16-17H2/t23?,24-,25?,26?,27?,28?/m1/s1
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0.658n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human kappa opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254123
PNG
(CHEMBL4068691)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H33N3O2/c33-21-7-6-19-13-25-28-9-8-24-26(20(15-28)17-32(24)27(34)23-3-1-2-11-30-23)29(28,22(19)14-21)10-12-31(25)16-18-4-5-18/h1-3,6-7,11,14,18,20,24-26,33H,4-5,8-10,12-13,15-17H2/t20-,24?,25?,26?,28?,29?/m1/s1
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0.726n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50253135
PNG
(CHEMBL4060073)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC(C)C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H34N2O3/c1-18(2)16-30-13-12-28-22-15-21(32)9-8-20(22)14-25(30)29(28)11-10-23-26(28)24(34-29)17-31(23)27(33)19-6-4-3-5-7-19/h3-9,15,18,23-26,32H,10-14,16-17H2,1-2H3/t23?,24-,25?,26?,28?,29?/m1/s1
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0.760n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from delta opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254122
PNG
(CHEMBL4098662)
Show SMILES [H][C@]12CN(CC3CCCCC3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H42N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h8-9,15,20-21,23,26-28,33H,1-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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0.781n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254131
PNG
(CHEMBL4094845)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1cnccn1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C27H32N4O/c32-20-4-3-18-11-23-26-6-5-22-25(19(13-26)16-31(22)24-14-28-8-9-29-24)27(26,21(18)12-20)7-10-30(23)15-17-1-2-17/h3-4,8-9,12,14,17,19,22-23,25,32H,1-2,5-7,10-11,13,15-16H2/t19-,22?,23?,25?,26?,27?/m1/s1
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0.813n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254120
PNG
(CHEMBL4076681)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Oc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O3/c33-22-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-22)12-13-31(26)17-19-6-7-19)21(16-29)18-32(25)28(34)35-23-4-2-1-3-5-23/h1-5,8-9,15,19,21,25-27,33H,6-7,10-14,16-18H2/t21-,25?,26?,27?,29?,30?/m1/s1
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0.826n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254120
PNG
(CHEMBL4076681)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)Oc1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C30H34N2O3/c33-22-9-8-20-14-26-29-11-10-25-27(30(29,24(20)15-22)12-13-31(26)17-19-6-7-19)21(16-29)18-32(25)28(34)35-23-4-2-1-3-5-23/h1-5,8-9,15,19,21,25-27,33H,6-7,10-14,16-18H2/t21-,25?,26?,27?,29?,30?/m1/s1
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0.833n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253136
PNG
(CHEMBL4075409)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC=C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H30N2O3/c1-2-13-29-14-12-27-21-16-20(31)9-8-19(21)15-24(29)28(27)11-10-22-25(27)23(33-28)17-30(22)26(32)18-6-4-3-5-7-18/h2-9,16,22-25,31H,1,10-15,17H2/t22?,23-,24?,25?,27?,28?/m1/s1
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0.833n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254121
PNG
(CHEMBL4067629)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H34N2O/c32-23-9-8-20-14-26-28-11-10-25-27(21(16-28)18-31(25)22-4-2-1-3-5-22)29(28,24(20)15-23)12-13-30(26)17-19-6-7-19/h1-5,8-9,15,19,21,25-27,32H,6-7,10-14,16-18H2/t21-,25?,26?,27?,28?,29?/m1/s1
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0.953n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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1.10n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human kappa opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50253129
PNG
(CHEMBL4066752)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,22:21:7:10.17.11,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H32N2O3/c32-21-9-8-20-14-25-29-11-10-23-26(24(34-29)17-31(23)27(33)19-4-2-1-3-5-19)28(29,22(20)15-21)12-13-30(25)16-18-6-7-18/h1-5,8-9,15,18,23-26,32H,6-7,10-14,16-17H2/t23?,24-,25?,26?,28?,29?/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254121
PNG
(CHEMBL4067629)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H34N2O/c32-23-9-8-20-14-26-28-11-10-25-27(21(16-28)18-31(25)22-4-2-1-3-5-22)29(28,24(20)15-23)12-13-30(26)17-19-6-7-19/h1-5,8-9,15,19,21,25-27,32H,6-7,10-14,16-18H2/t21-,25?,26?,27?,28?,29?/m1/s1
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1.30n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50253158
PNG
(CHEMBL4100943)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:3:11:25:15.1,2:1:25:12.13.11,13:14:28.27.26:17.24.18,24:25:15.1:12.13.11,29:28:14:17.24.18,23:24:28.27.26:14,THB:26:25:15.1:12.13.11|
Show InChI InChI=1S/C29H34N2O2/c32-22-9-8-21-14-26-29-11-10-24-27(25(33-29)18-31(24)17-19-4-2-1-3-5-19)28(29,23(21)15-22)12-13-30(26)16-20-6-7-20/h1-5,8-9,15,20,24-27,32H,6-7,10-14,16-18H2/t24?,25-,26?,27?,28?,29?/m1/s1
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1.40n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human kappa opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50254122
PNG
(CHEMBL4098662)
Show SMILES [H][C@]12CN(CC3CCCCC3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H42N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h8-9,15,20-21,23,26-28,33H,1-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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1.5n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DPDPE from human recombinant DOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50253158
PNG
(CHEMBL4100943)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:3:11:25:15.1,2:1:25:12.13.11,13:14:28.27.26:17.24.18,24:25:15.1:12.13.11,29:28:14:17.24.18,23:24:28.27.26:14,THB:26:25:15.1:12.13.11|
Show InChI InChI=1S/C29H34N2O2/c32-22-9-8-21-14-26-29-11-10-24-27(25(33-29)18-31(24)17-19-4-2-1-3-5-19)28(29,23(21)15-22)12-13-30(26)16-20-6-7-20/h1-5,8-9,15,20,24-27,32H,6-7,10-14,16-18H2/t24?,25-,26?,27?,28?,29?/m1/s1
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1.60n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human mu opioid receptor expressed in CHO cells


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254121
PNG
(CHEMBL4067629)
Show SMILES [H][C@]12CN(C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23)c1ccccc1 |r,TLB:17:18:4.6.5:8.1,16:17:7:21.20.19,6:7:21.20.19:10.11.17,8:7:21.20.19:10.11.17,2:1:18:4.6.5,3:4:18:8.1,22:21:7:10.11.17,THB:12:11:7:21.20.19,19:18:4.6.5:8.1|
Show InChI InChI=1S/C29H34N2O/c32-23-9-8-20-14-26-28-11-10-25-27(21(16-28)18-31(25)22-4-2-1-3-5-22)29(28,24(20)15-23)12-13-30(26)17-19-6-7-19/h1-5,8-9,15,19,21,25-27,32H,6-7,10-14,16-18H2/t21-,25?,26?,27?,28?,29?/m1/s1
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2.40n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254122
PNG
(CHEMBL4098662)
Show SMILES [H][C@]12CN(CC3CCCCC3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H42N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h8-9,15,20-21,23,26-28,33H,1-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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2.5n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50253136
PNG
(CHEMBL4075409)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC=C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C28H30N2O3/c1-2-13-29-14-12-27-21-16-20(31)9-8-19(21)15-24(29)28(27)11-10-22-25(27)23(33-28)17-30(22)26(32)18-6-4-3-5-7-18/h2-9,16,22-25,31H,1,10-15,17H2/t22?,23-,24?,25?,27?,28?/m1/s1
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2.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from kappa opioid receptor in guinea pig cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50254130
PNG
(CHEMBL4061334)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H36N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h1-5,8-9,15,21,23,26-28,33H,6-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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3.40n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant MOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253137
PNG
(CHEMBL4076673)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CCCOC)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H34N2O4/c1-34-15-5-13-30-14-12-28-22-17-21(32)9-8-20(22)16-25(30)29(28)11-10-23-26(28)24(35-29)18-31(23)27(33)19-6-3-2-4-7-19/h2-4,6-9,17,23-26,32H,5,10-16,18H2,1H3/t23?,24-,25?,26?,28?,29?/m1/s1
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3.90n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50254130
PNG
(CHEMBL4061334)
Show SMILES [H][C@]12CN(Cc3ccccc3)C3CCC4(C1)C1Cc5ccc(O)cc5C4(CCN1CC1CC1)C23 |r,TLB:24:25:11.13.12:15.1,23:24:14:28.27.26,13:14:28.27.26:17.18.24,15:14:28.27.26:17.18.24,2:1:25:11.13.12,3:11:25:15.1,29:28:14:17.18.24,THB:19:18:14:28.27.26,26:25:11.13.12:15.1|
Show InChI InChI=1S/C30H36N2O/c33-24-9-8-22-14-27-29-11-10-26-28(23(16-29)19-32(26)18-20-4-2-1-3-5-20)30(29,25(22)15-24)12-13-31(27)17-21-6-7-21/h1-5,8-9,15,21,23,26-28,33H,6-7,10-14,16-19H2/t23-,26?,27?,28?,29?,30?/m1/s1
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4.30n/an/an/an/an/an/an/an/a



Nippon Chemiphar Co., Ltd

Curated by ChEMBL


Assay Description
Displacement of [3H]U-69,593 from human recombinant KOR expressed in CHO cell membranes


Bioorg Med Chem Lett 27: 3495-3498 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.072
BindingDB Entry DOI: 10.7270/Q25H7JPK
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50253135
PNG
(CHEMBL4060073)
Show SMILES [H][C@]12CN(C3CCC4(O1)C1Cc5ccc(O)cc5C4(CCN1CC(C)C)C23)C(=O)c1ccccc1 |r,TLB:3:4:18:8.1,2:1:18:5.6.4,6:7:21.20.19:10.17.11,17:18:8.1:5.6.4,16:17:21.20.19:7,THB:19:18:8.1:5.6.4|
Show InChI InChI=1S/C29H34N2O3/c1-18(2)16-30-13-12-28-22-15-21(32)9-8-20(22)14-25(30)29(28)11-10-23-26(28)24(34-29)17-31(23)27(33)19-6-4-3-5-7-19/h3-9,15,18,23-26,32H,10-14,16-17H2,1-2H3/t23?,24-,25?,26?,28?,29?/m1/s1
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4.5n/an/an/an/an/an/an/an/a



Laboratory of Medicinal Chemistry, School of Pharmacy, Kitasato University, 5-9-1, Shirokane, Minato-ku, Tokyo 108-8641, Japan; Discovery Research Laboratories, Nippon Chemiphar Co., Ltd., 1-22, Hiko

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in mouse whole brain without cerebellum membrane


Bioorg Med Chem Lett 27: 2742-2745 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.059
BindingDB Entry DOI: 10.7270/Q2H134GP
More data for this
Ligand-Target Pair
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