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Compile Data Set for Download or QSAR

Found 1826 hits with Last Name = 'ida' and Initial = 'y'   
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
Translocator protein


(Rattus norvegicus (rat))
BDBM50122293
PNG
(CHEMBL401000 | CHEMBL63064 | N-(2,5-Dimethoxy-benz...)
Show SMILES COc1ccc(OC)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H22FNO4/c1-16(26)25(15-17-13-20(27-2)10-12-22(17)28-3)21-14-18(24)9-11-23(21)29-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3
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0.0430n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro binding affinity for PBR (peripheral benzodiazepine receptor) in rat brain


Bioorg Med Chem Lett 13: 201-4 (2002)


BindingDB Entry DOI: 10.7270/Q2PZ585X
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50122294
PNG
(CHEMBL292092 | N-(5-fluoro-2-phenoxyphenyl)-N-(2-(...)
Show SMILES COc1ccc(OCCF)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C24H23F2NO4/c1-17(28)27(16-18-14-21(29-2)9-11-23(18)30-13-12-25)22-15-19(26)8-10-24(22)31-20-6-4-3-5-7-20/h3-11,14-15H,12-13,16H2,1-2H3
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0.0780n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro inhibition of [11C]2 binding to Peripheral benzodiazepine receptor (PBR) in rat brain


J Med Chem 47: 2228-35 (2004)


Article DOI: 10.1021/jm0304919
BindingDB Entry DOI: 10.7270/Q20G3KXQ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391602
PNG
(CHEMBL2147915)
Show SMILES CN1CC[C@]23Cc4nc5c(O)cccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H24N2O3/c1-26-8-7-23-13-19-16(9-15-3-2-4-20(28)22(15)25-19)12-24(23,29)21(26)10-14-5-6-17(27)11-18(14)23/h2-6,9,11,21,27-29H,7-8,10,12-13H2,1H3/t21-,23-,24-/m1/s1
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0.0920n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50360146
PNG
(CHEMBL1929368)
Show SMILES Oc1ccc2C[C@@H]3[C@@H]4Cc5cc6ccccc6nc5C[C@]4(CCN3CC3CCC3)c2c1 |r,THB:24:23:7:29.4.5|
Show InChI InChI=1S/C28H30N2O/c31-22-9-8-19-14-27-24-13-21-12-20-6-1-2-7-25(20)29-26(21)16-28(24,23(19)15-22)10-11-30(27)17-18-4-3-5-18/h1-2,6-9,12,15,18,24,27,31H,3-5,10-11,13-14,16-17H2/t24-,27+,28+/m0/s1
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0.120n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50294428
PNG
(CHEMBL552308 | SN-28)
Show SMILES CN1CC[C@]23Cc4nc5ccccc5cc4C[C@H]2[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:17:26.20.19|
Show InChI InChI=1S/C24H24N2O/c1-26-9-8-24-14-22-17(10-16-4-2-3-5-21(16)25-22)11-20(24)23(26)12-15-6-7-18(27)13-19(15)24/h2-7,10,13,20,23,27H,8-9,11-12,14H2,1H3/t20-,23+,24+/m0/s1
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0.140n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor in rat cerebrum membranes


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494888
PNG
(CHEMBL4296733)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CC)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:30:15.14.13,THB:10:11:30:15.14.13|
Show InChI InChI=1S/C25H26N2O2.2ClH/c1-2-27-10-9-24-15-22-18(11-17-5-3-4-6-21(17)26-22)14-25(24,29)23(27)12-16-7-8-19(28)13-20(16)24;;/h3-8,11,13,23,28-29H,2,9-10,12,14-15H2,1H3;2*1H/t23-,24-,25-;;/m1../s1
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0.141n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391591
PNG
(CHEMBL2147904)
Show SMILES CN1CC[C@]23Cc4nc5cccc(F)c5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H23FN2O2/c1-27-8-7-23-13-21-15(9-17-19(25)3-2-4-20(17)26-21)12-24(23,29)22(27)10-14-5-6-16(28)11-18(14)23/h2-6,9,11,22,28-29H,7-8,10,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.143n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50329100
PNG
(CHEMBL1270475)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]4(Cc5nc6ccccc6cc5C[C@@]34O)c2c1 |r,THB:8:7:27:4.29.5|
Show InChI InChI=1S/C27H28N2O2/c30-21-8-7-18-12-25-27(31)14-20-11-19-3-1-2-4-23(19)28-24(20)15-26(27,22(18)13-21)9-10-29(25)16-17-5-6-17/h1-4,7-8,11,13,17,25,30-31H,5-6,9-10,12,14-16H2/t25-,26-,27-/m1/s1
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0.143n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391594
PNG
(CHEMBL2147907)
Show SMILES CN1CC[C@]23Cc4nc5c(F)cccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H23FN2O2/c1-27-8-7-23-13-20-16(9-15-3-2-4-19(25)22(15)26-20)12-24(23,29)21(27)10-14-5-6-17(28)11-18(14)23/h2-6,9,11,21,28-29H,7-8,10,12-13H2,1H3/t21-,23-,24-/m1/s1
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0.146n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391595
PNG
(CHEMBL2147908)
Show SMILES CN1CC[C@]23Cc4nc5cccc(C)c5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C25H26N2O2/c1-15-4-3-5-21-19(15)10-17-13-25(29)23-11-16-6-7-18(28)12-20(16)24(25,8-9-27(23)2)14-22(17)26-21/h3-7,10,12,23,28-29H,8-9,11,13-14H2,1-2H3/t23-,24-,25-/m1/s1
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0.148n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391603
PNG
(CHEMBL2147916)
Show SMILES COc1cccc2nc3C[C@]45CCN(C)[C@H](Cc6ccc(O)cc46)[C@]5(O)Cc3cc12 |r,TLB:14:13:24:23.17.16|
Show InChI InChI=1S/C25H26N2O3/c1-27-9-8-24-14-21-16(10-18-20(26-21)4-3-5-22(18)30-2)13-25(24,29)23(27)11-15-6-7-17(28)12-19(15)24/h3-7,10,12,23,28-29H,8-9,11,13-14H2,1-2H3/t23-,24-,25-/m1/s1
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0.151n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50329095
PNG
(CHEMBL1270282)
Show SMILES CN1CC[C@]23Cc4nc5ccccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:17:21.27.20|
Show InChI InChI=1S/C24H24N2O2/c1-26-9-8-23-14-21-17(10-16-4-2-3-5-20(16)25-21)13-24(23,28)22(26)11-15-6-7-18(27)12-19(15)23/h2-7,10,12,22,27-28H,8-9,11,13-14H2,1H3/t22-,23-,24-/m1/s1
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0.160n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50329095
PNG
(CHEMBL1270282)
Show SMILES CN1CC[C@]23Cc4nc5ccccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:17:21.27.20|
Show InChI InChI=1S/C24H24N2O2/c1-26-9-8-23-14-21-17(10-16-4-2-3-5-20(16)25-21)13-24(23,28)22(26)11-15-6-7-18(27)12-19(15)23/h2-7,10,12,22,27-28H,8-9,11,13-14H2,1H3/t22-,23-,24-/m1/s1
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0.160n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50122293
PNG
(CHEMBL401000 | CHEMBL63064 | N-(2,5-Dimethoxy-benz...)
Show SMILES COc1ccc(OC)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H22FNO4/c1-16(26)25(15-17-13-20(27-2)10-12-22(17)28-3)21-14-18(24)9-11-23(21)29-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3
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0.160n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro inhibition of [11C]2 binding to Peripheral benzodiazepine receptor (PBR) in rat brain


J Med Chem 47: 2228-35 (2004)


Article DOI: 10.1021/jm0304919
BindingDB Entry DOI: 10.7270/Q20G3KXQ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494882
PNG
(CHEMBL4296730)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCC)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:31:15.14.13,THB:10:11:31:15.14.13|
Show InChI InChI=1S/C26H28N2O2.2ClH/c1-2-10-28-11-9-25-16-23-19(12-18-5-3-4-6-22(18)27-23)15-26(25,30)24(28)13-17-7-8-20(29)14-21(17)25;;/h3-8,12,14,24,29-30H,2,9-11,13,15-16H2,1H3;2*1H/t24-,25-,26-;;/m1../s1
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0.162n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Translocator protein


(Rattus norvegicus (rat))
BDBM50122295
PNG
(CHEMBL63065 | N-(2-Fluoromethoxy-5-methoxy-benzyl)...)
Show SMILES COc1ccc(OCF)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H21F2NO4/c1-16(27)26(14-17-12-20(28-2)9-11-22(17)29-15-24)21-13-18(25)8-10-23(21)30-19-6-4-3-5-7-19/h3-13H,14-15H2,1-2H3
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0.170n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro inhibition of [11C]2 binding to Peripheral benzodiazepine receptor (PBR) in rat brain


J Med Chem 47: 2228-35 (2004)


Article DOI: 10.1021/jm0304919
BindingDB Entry DOI: 10.7270/Q20G3KXQ
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM21864
PNG
((21R)-22-(cyclopropylmethyl)-14-oxa-11,22-diazahep...)
Show SMILES [H][C@@]12Cc3ccc(O)c4OC5c6[nH]c7ccccc7c6CC1(O)C5(CCN2CC1CC1)c34 |THB:27:26:21:31.2.3|
Show InChI InChI=1S/C26H26N2O3/c29-19-8-7-15-11-20-26(30)12-17-16-3-1-2-4-18(16)27-22(17)24-25(26,21(15)23(19)31-24)9-10-28(20)13-14-5-6-14/h1-4,7-8,14,20,24,27,29-30H,5-6,9-13H2/t20-,24?,25?,26?/m0/s1
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0.170n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Translocator protein


(Homo sapiens (Human))
BDBM50122293
PNG
(CHEMBL401000 | CHEMBL63064 | N-(2,5-Dimethoxy-benz...)
Show SMILES COc1ccc(OC)c(CN(C(C)=O)c2cc(F)ccc2Oc2ccccc2)c1
Show InChI InChI=1S/C23H22FNO4/c1-16(26)25(15-17-13-20(27-2)10-12-22(17)28-3)21-14-18(24)9-11-23(21)29-19-7-5-4-6-8-19/h4-14H,15H2,1-3H3
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0.188n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
In vitro binding affinity for PBR (peripheral benzodiazepine receptor) in monkey brain


Bioorg Med Chem Lett 13: 201-4 (2002)


BindingDB Entry DOI: 10.7270/Q2PZ585X
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50294426
PNG
(CHEMBL559518 | SN-11)
Show SMILES Oc1ccc2C[C@@H]3[C@@H]4Cc5cc6ccccc6nc5C[C@]4(CCN3CC3CC3)c2c1 |r,THB:24:23:7:28.4.5|
Show InChI InChI=1S/C27H28N2O/c30-21-8-7-18-13-26-23-12-20-11-19-3-1-2-4-24(19)28-25(20)15-27(23,22(18)14-21)9-10-29(26)16-17-5-6-17/h1-4,7-8,11,14,17,23,26,30H,5-6,9-10,12-13,15-16H2/t23-,26+,27+/m0/s1
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0.190n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor in rat cerebrum membranes


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50294427
PNG
(CHEMBL564538 | SN-23)
Show SMILES CC(C)CN1CC[C@]23Cc4nc5ccccc5cc4C[C@H]2[C@H]1Cc1ccc(O)cc31 |r,THB:3:4:20:29.23.22|
Show InChI InChI=1S/C27H30N2O/c1-17(2)16-29-10-9-27-15-25-20(11-19-5-3-4-6-24(19)28-25)12-23(27)26(29)13-18-7-8-21(30)14-22(18)27/h3-8,11,14,17,23,26,30H,9-10,12-13,15-16H2,1-2H3/t23-,26+,27+/m0/s1
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0.190n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor in rat cerebrum membranes


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494879
PNG
(CHEMBL4296729)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CC1(O)CC1)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:33:15.14.13,THB:10:11:33:15.14.13|
Show InChI InChI=1S/C27H28N2O3.2ClH/c30-20-6-5-17-12-24-27(32)14-19-11-18-3-1-2-4-22(18)28-23(19)15-26(27,21(17)13-20)9-10-29(24)16-25(31)7-8-25;;/h1-6,11,13,24,30-32H,7-10,12,14-16H2;2*1H/t24-,26-,27-;;/m1../s1
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0.208n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494890
PNG
(CHEMBL4296726)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1Cc1ccco1)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:34:15.14.13,THB:10:11:34:15.14.13|
Show InChI InChI=1S/C28H26N2O3.2ClH/c31-21-8-7-18-13-26-28(32)15-20-12-19-4-1-2-6-24(19)29-25(20)16-27(28,23(18)14-21)9-10-30(26)17-22-5-3-11-33-22;;/h1-8,11-12,14,26,31-32H,9-10,13,15-17H2;2*1H/t26-,27-,28-;;/m1../s1
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0.208n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494887
PNG
(CHEMBL4296731)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCF)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:31:15.14.13,THB:10:11:31:15.14.13|
Show InChI InChI=1S/C25H25FN2O2.2ClH/c26-8-10-28-9-7-24-15-22-18(11-17-3-1-2-4-21(17)27-22)14-25(24,30)23(28)12-16-5-6-19(29)13-20(16)24;;/h1-6,11,13,23,29-30H,7-10,12,14-15H2;2*1H/t23-,24-,25-;;/m1../s1
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0.213n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391582
PNG
(CHEMBL2147927)
Show SMILES CN1CC[C@]23Cc4nc5c(cccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31)[N+]([O-])=O |r,THB:0:1:17:27.21.20|
Show InChI InChI=1S/C24H23N3O4/c1-26-8-7-23-13-19-16(9-15-3-2-4-20(27(30)31)22(15)25-19)12-24(23,29)21(26)10-14-5-6-17(28)11-18(14)23/h2-6,9,11,21,28-29H,7-8,10,12-13H2,1H3/t21-,23-,24-/m1/s1
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0.218n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494880
PNG
(CHEMBL4296736)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCOCC)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:33:15.14.13,THB:10:11:33:15.14.13|
Show InChI InChI=1S/C27H30N2O3.2ClH/c1-2-32-12-11-29-10-9-26-17-24-20(13-19-5-3-4-6-23(19)28-24)16-27(26,31)25(29)14-18-7-8-21(30)15-22(18)26;;/h3-8,13,15,25,30-31H,2,9-12,14,16-17H2,1H3;2*1H/t25-,26-,27-;;/m1../s1
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0.224n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494881
PNG
(CHEMBL4296739)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1C[C@@H](C)O)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:32:15.14.13,THB:10:11:32:15.14.13|
Show InChI InChI=1S/C26H28N2O3.2ClH/c1-16(29)15-28-9-8-25-14-23-19(10-18-4-2-3-5-22(18)27-23)13-26(25,31)24(28)11-17-6-7-20(30)12-21(17)25;;/h2-7,10,12,16,24,29-31H,8-9,11,13-15H2,1H3;2*1H/t16-,24-,25-,26-;;/m1../s1
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0.225n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50325534
PNG
(CHEMBL267495 | nalfurafine)
Show SMILES CN([C@@H]1CC[C@@]2(O)[C@H]3Cc4ccc(O)c5O[C@@H]1[C@]2(CCN3CC1CC1)c45)C(=O)\C=C\c1ccoc1
Show InChI InChI=1S/C28H32N2O5/c1-29(23(32)7-4-18-9-13-34-16-18)20-8-10-28(33)22-14-19-5-6-21(31)25-24(19)27(28,26(20)35-25)11-12-30(22)15-17-2-3-17/h4-7,9,13,16-17,20,22,26,31,33H,2-3,8,10-12,14-15H2,1H3/b7-4+/t20-,22-,26+,27+,28-/m1/s1
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0.225n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem Lett 20: 5035-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.035
BindingDB Entry DOI: 10.7270/Q2CJ8DPH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Delta-type opioid receptor


(MOUSE)
BDBM50391590
PNG
(CHEMBL2147903)
Show SMILES CN1CC[C@]23Cc4nc5c(Cl)cccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H23ClN2O2/c1-27-8-7-23-13-20-16(9-15-3-2-4-19(25)22(15)26-20)12-24(23,29)21(27)10-14-5-6-17(28)11-18(14)23/h2-6,9,11,21,28-29H,7-8,10,12-13H2,1H3/t21-,23-,24-/m1/s1
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0.235n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391607
PNG
(CHEMBL2147920)
Show SMILES CN1CC[C@]23Cc4nc5cccc(c5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31)C(F)(F)F |r,THB:0:1:17:27.21.20|
Show InChI InChI=1S/C25H23F3N2O2/c1-30-8-7-23-13-21-15(9-17-18(25(26,27)28)3-2-4-20(17)29-21)12-24(23,32)22(30)10-14-5-6-16(31)11-19(14)23/h2-6,9,11,22,31-32H,7-8,10,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.244n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494891
PNG
(CHEMBL4296722)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCOC)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:32:15.14.13,THB:10:11:32:15.14.13|
Show InChI InChI=1S/C26H28N2O3.2ClH/c1-31-11-10-28-9-8-25-16-23-19(12-18-4-2-3-5-22(18)27-23)15-26(25,30)24(28)13-17-6-7-20(29)14-21(17)25;;/h2-7,12,14,24,29-30H,8-11,13,15-16H2,1H3;2*1H/t24-,25-,26-;;/m1../s1
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0.244n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391593
PNG
(CHEMBL2147906)
Show SMILES CN1CC[C@]23Cc4nc5cc(F)ccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H23FN2O2/c1-27-7-6-23-13-21-16(8-15-2-4-17(25)10-20(15)26-21)12-24(23,29)22(27)9-14-3-5-18(28)11-19(14)23/h2-5,8,10-11,22,28-29H,6-7,9,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.255n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494884
PNG
(CHEMBL4296737)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1C[C@@H]1CCCO1)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:34:15.14.13,THB:10:11:34:15.14.13|
Show InChI InChI=1S/C28H30N2O3.2ClH/c31-21-8-7-18-13-26-28(32)15-20-12-19-4-1-2-6-24(19)29-25(20)16-27(28,23(18)14-21)9-10-30(26)17-22-5-3-11-33-22;;/h1-2,4,6-8,12,14,22,26,31-32H,3,5,9-11,13,15-17H2;2*1H/t22-,26+,27+,28+;;/m0../s1
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0.257n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391598
PNG
(CHEMBL2147911)
Show SMILES CN1CC[C@]23Cc4nc5c(C)cccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C25H26N2O2/c1-15-4-3-5-17-10-18-13-25(29)22-11-16-6-7-19(28)12-20(16)24(25,8-9-27(22)2)14-21(18)26-23(15)17/h3-7,10,12,22,28-29H,8-9,11,13-14H2,1-2H3/t22-,24-,25-/m1/s1
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0.267n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50360142
PNG
(CHEMBL1929365)
Show SMILES Oc1cccc2C[C@@H]3[C@@H]4Cc5cc6ccccc6nc5C[C@]4(CCN3CC3CC3)c12 |r,THB:25:24:8:29.5.6|
Show InChI InChI=1S/C27H28N2O/c30-25-7-3-5-19-14-24-21-13-20-12-18-4-1-2-6-22(18)28-23(20)15-27(21,26(19)25)10-11-29(24)16-17-8-9-17/h1-7,12,17,21,24,30H,8-11,13-16H2/t21-,24+,27-/m0/s1
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0.270n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor in rat cerebrum membranes


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Rattus norvegicus (Rat))
BDBM50312840
PNG
(CHEMBL1076680 | US9139546, 16 | [11C](3',5'-dichlo...)
Show SMILES COc1cc(cc(OC)c1-c1cc(Cl)cc(Cl)c1)C(O)c1cccs1
Show InChI InChI=1S/C19H16Cl2O3S/c1-23-15-8-12(19(22)17-4-3-5-25-17)9-16(24-2)18(15)11-6-13(20)10-14(21)7-11/h3-10,19,22H,1-2H3
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0.270n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
Binding affinity to rat brain CB2 receptor


Bioorg Med Chem Lett 20: 1565-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.074
BindingDB Entry DOI: 10.7270/Q2N29X34
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494878
PNG
(CHEMBL4296732)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1C[C@H](C)O)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:32:15.14.13,THB:10:11:32:15.14.13|
Show InChI InChI=1S/C26H28N2O3.2ClH/c1-16(29)15-28-9-8-25-14-23-19(10-18-4-2-3-5-22(18)27-23)13-26(25,31)24(28)11-17-6-7-20(30)12-21(17)25;;/h2-7,10,12,16,24,29-31H,8-9,11,13-15H2,1H3;2*1H/t16-,24+,25+,26+;;/m0../s1
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0.277n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391601
PNG
(CHEMBL2147914)
Show SMILES CN1CC[C@]23Cc4nc5cc(O)ccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H24N2O3/c1-26-7-6-23-13-21-16(8-15-3-5-18(28)11-20(15)25-21)12-24(23,29)22(26)9-14-2-4-17(27)10-19(14)23/h2-5,8,10-11,22,27-29H,6-7,9,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.280n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM21864
PNG
((21R)-22-(cyclopropylmethyl)-14-oxa-11,22-diazahep...)
Show SMILES [H][C@@]12Cc3ccc(O)c4OC5c6[nH]c7ccccc7c6CC1(O)C5(CCN2CC1CC1)c34 |THB:27:26:21:31.2.3|
Show InChI InChI=1S/C26H26N2O3/c29-19-8-7-15-11-20-26(30)12-17-16-3-1-2-4-18(16)27-22(17)24-25(26,21(15)23(19)31-24)9-10-28(20)13-14-5-6-14/h1-4,7-8,14,20,24,27,29-30H,5-6,9-13H2/t20-,24?,25?,26?/m0/s1
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0.290n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor in rat cerebrum membranes


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50294428
PNG
(CHEMBL552308 | SN-28)
Show SMILES CN1CC[C@]23Cc4nc5ccccc5cc4C[C@H]2[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:17:26.20.19|
Show InChI InChI=1S/C24H24N2O/c1-26-9-8-24-14-22-17(10-16-4-2-3-5-21(16)25-22)11-20(24)23(26)12-15-6-7-18(27)13-19(15)24/h2-7,10,13,20,23,27H,8-9,11-12,14H2,1H3/t20-,23+,24+/m0/s1
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0.290n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494886
PNG
(CHEMBL4296735)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCO)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:31:15.14.13,THB:10:11:31:15.14.13|
Show InChI InChI=1S/C25H26N2O3.2ClH/c28-10-9-27-8-7-24-15-22-18(11-17-3-1-2-4-21(17)26-22)14-25(24,30)23(27)12-16-5-6-19(29)13-20(16)24;;/h1-6,11,13,23,28-30H,7-10,12,14-15H2;2*1H/t23-,24-,25-;;/m1../s1
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0.314n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494877
PNG
(CHEMBL4296738)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1Cc1ccoc1)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:34:15.14.13,THB:10:11:34:15.14.13|
Show InChI InChI=1S/C28H26N2O3.2ClH/c31-22-6-5-19-12-26-28(32)14-21-11-20-3-1-2-4-24(20)29-25(21)15-27(28,23(19)13-22)8-9-30(26)16-18-7-10-33-17-18;;/h1-7,10-11,13,17,26,31-32H,8-9,12,14-16H2;2*1H/t26-,27-,28-;;/m1../s1
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0.324n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Metabotropic glutamate receptor 1


(Homo sapiens (Human))
BDBM50163592
PNG
((3,4-Dihydro-2H-1-oxa-9-aza-anthracen-6-yl)-(4-met...)
Show SMILES CO[C@H]1CC[C@H](CC1)C(=O)c1ccc2nc3OCCCc3cc2c1 |wU:5.8,2.1,(-8.6,-.89,;-7.27,-1.66,;-5.94,-.89,;-5.94,.65,;-4.61,1.42,;-3.28,.65,;-3.28,-.89,;-4.61,-1.66,;-1.95,1.42,;-1.98,2.96,;-.62,.67,;-.62,-.87,;.72,-1.64,;2.05,-.85,;3.39,-1.62,;4.72,-.82,;6.07,-1.57,;7.4,-.8,;7.38,.76,;6.03,1.51,;4.7,.72,;3.36,1.49,;2.04,.69,;.71,1.44,)|
Show InChI InChI=1S/C20H23NO3/c1-23-17-7-4-13(5-8-17)19(22)14-6-9-18-16(11-14)12-15-3-2-10-24-20(15)21-18/h6,9,11-13,17H,2-5,7-8,10H2,1H3/t13-,17+
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0.340n/an/an/an/an/an/an/an/a



National Institute of Radiological Sciences

Curated by ChEMBL


Assay Description
Binding affinity to mGluR1


Bioorg Med Chem 19: 102-10 (2011)


Article DOI: 10.1016/j.bmc.2010.11.048
BindingDB Entry DOI: 10.7270/Q21R6QSS
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391596
PNG
(CHEMBL2147909)
Show SMILES CN1CC[C@]23Cc4nc5ccc(C)cc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C25H26N2O2/c1-15-3-6-21-17(9-15)10-18-13-25(29)23-11-16-4-5-19(28)12-20(16)24(25,7-8-27(23)2)14-22(18)26-21/h3-6,9-10,12,23,28-29H,7-8,11,13-14H2,1-2H3/t23-,24-,25-/m1/s1
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0.340n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50494876
PNG
(CHEMBL4296734)
Show SMILES Cl.Cl.[H][C@]12Cc3ccc(O)cc3[C@@]3(CCN1CCCOC)Cc1nc4ccccc4cc1C[C@@]23O |r,TLB:6:5:33:15.14.13,THB:10:11:33:15.14.13|
Show InChI InChI=1S/C27H30N2O3.2ClH/c1-32-12-4-10-29-11-9-26-17-24-20(13-19-5-2-3-6-23(19)28-24)16-27(26,31)25(29)14-18-7-8-21(30)15-22(18)26;;/h2-3,5-8,13,15,25,30-31H,4,9-12,14,16-17H2,1H3;2*1H/t25-,26-,27-;;/m1../s1
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0.342n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Displacement of [3H]-DPDPE from delta opioid receptor in mouse whole brain membranes without cerebellum after 1 hr by liquid scintillation counting a...


Bioorg Med Chem 21: 7628-47 (2013)


Article DOI: 10.1016/j.bmc.2013.10.032
BindingDB Entry DOI: 10.7270/Q2VM4G71
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50325531
PNG
(CHEMBL1223834)
Show SMILES Cn1c(CCC(=O)CCc2ccccc2)cc2C[C@@]3(O)[C@H]4Cc5ccc(O)c6O[C@@H](c12)[C@]3(CCN4CC1CC1)c56 |r|
Show InChI InChI=1S/C34H38N2O4/c1-35-25(11-13-26(37)12-9-21-5-3-2-4-6-21)17-24-19-34(39)28-18-23-10-14-27(38)31-29(23)33(34,32(40-31)30(24)35)15-16-36(28)20-22-7-8-22/h2-6,10,14,17,22,28,32,38-39H,7-9,11-13,15-16,18-20H2,1H3/t28-,32+,33+,34-/m1/s1
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0.342n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem Lett 20: 5035-8 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.035
BindingDB Entry DOI: 10.7270/Q2CJ8DPH
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391579
PNG
(CHEMBL2147924)
Show SMILES CN1CC[C@]23Cc4nc5cccc([N+]([O-])=O)c5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:20:30.24.23|
Show InChI InChI=1S/C24H23N3O4/c1-26-8-7-23-13-20-15(9-17-19(25-20)3-2-4-21(17)27(30)31)12-24(23,29)22(26)10-14-5-6-16(28)11-18(14)23/h2-6,9,11,22,28-29H,7-8,10,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.344n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50360147
PNG
(CHEMBL1929369)
Show SMILES Oc1ccc2C[C@@H]3[C@@H]4Cc5cc6ccccc6nc5C[C@]4(CCN3CC3CCCC3)c2c1 |r,THB:24:23:7:30.4.5|
Show InChI InChI=1S/C29H32N2O/c32-23-10-9-20-15-28-25-14-22-13-21-7-3-4-8-26(21)30-27(22)17-29(25,24(20)16-23)11-12-31(28)18-19-5-1-2-6-19/h3-4,7-10,13,16,19,25,28,32H,1-2,5-6,11-12,14-15,17-18H2/t25-,28+,29+/m0/s1
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0.350n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391587
PNG
(CHEMBL2147891)
Show SMILES CN1CC[C@]23Cc4nc5cccc(Cl)c5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C24H23ClN2O2/c1-27-8-7-23-13-21-15(9-17-19(25)3-2-4-20(17)26-21)12-24(23,29)22(27)10-14-5-6-16(28)11-18(14)23/h2-6,9,11,22,28-29H,7-8,10,12-13H2,1H3/t22-,23-,24-/m1/s1
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0.353n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50294426
PNG
(CHEMBL559518 | SN-11)
Show SMILES Oc1ccc2C[C@@H]3[C@@H]4Cc5cc6ccccc6nc5C[C@]4(CCN3CC3CC3)c2c1 |r,THB:24:23:7:28.4.5|
Show InChI InChI=1S/C27H28N2O/c30-21-8-7-18-13-26-23-12-20-11-19-3-1-2-4-24(19)28-25(20)15-27(23,22(18)14-21)9-10-29(26)16-17-5-6-17/h1-4,7-8,11,14,17,23,26,30H,5-6,9-10,12-13,15-16H2/t23-,26+,27+/m0/s1
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0.360n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 949-61 (2012)


Article DOI: 10.1016/j.bmc.2011.11.047
BindingDB Entry DOI: 10.7270/Q2H995MX
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50391597
PNG
(CHEMBL2147910)
Show SMILES CN1CC[C@]23Cc4nc5cc(C)ccc5cc4C[C@@]2(O)[C@H]1Cc1ccc(O)cc31 |r,THB:0:1:18:28.22.21|
Show InChI InChI=1S/C25H26N2O2/c1-15-3-4-17-10-18-13-25(29)23-11-16-5-6-19(28)12-20(16)24(25,7-8-27(23)2)14-22(18)26-21(17)9-15/h3-6,9-10,12,23,28-29H,7-8,11,13-14H2,1-2H3/t23-,24-,25-/m1/s1
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0.362n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


Bioorg Med Chem 20: 5810-31 (2012)


Article DOI: 10.1016/j.bmc.2012.08.004
BindingDB Entry DOI: 10.7270/Q2F190T5
More data for this
Ligand-Target Pair
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