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Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 50046227   
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
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM21130
PNG
(N-methyl-2-phenyl-N-[(5R,7S,8S)-7-(pyrrolidin-1-yl...)
Show SMILES CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1)C(=O)Cc1ccccc1
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)19-10-12-22(11-7-15-26-22)17-20(19)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22-/m0/s1
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1.40n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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1.70n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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4.60n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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6.10n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101309
PNG
(CHEMBL3326360)
Show SMILES COc1cccc(c1)[C@@]1(C)O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(14-7-5-9-16(11-14)24-3)18-22-17(12-25-18)26-21(2,19(22)27-20)13-6-4-8-15(23)10-13/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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53n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101314
PNG
(CHEMBL3326355)
Show SMILES CC1(OC2N3C(COC13)OC2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3
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293n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101314
PNG
(CHEMBL3326355)
Show SMILES CC1(OC2N3C(COC13)OC2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3
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651n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101326
PNG
(CHEMBL3326350)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27+/m0/s1
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652n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101326
PNG
(CHEMBL3326350)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27+/m0/s1
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667n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101316
PNG
(CHEMBL3326352)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20-/m0/s1
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735n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101316
PNG
(CHEMBL3326352)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20-/m0/s1
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793n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101325
PNG
(CHEMBL3326351)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26+,27+/m0/s1
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928n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101315
PNG
(CHEMBL3326353)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101327
PNG
(CHEMBL3326349)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101325
PNG
(CHEMBL3326351)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26+,27+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101315
PNG
(CHEMBL3326353)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101314
PNG
(CHEMBL3326355)
Show SMILES CC1(OC2N3C(COC13)OC2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101313
PNG
(CHEMBL3326356)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101312
PNG
(CHEMBL3326357)
Show SMILES C[C@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101311
PNG
(CHEMBL3326358)
Show SMILES C[C@@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101310
PNG
(CHEMBL3326359)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(OC)c1
Show InChI InChI=1S/C22H25NO5/c1-21(14-7-5-9-16(11-14)24-3)19-23-18(13-26-19)27-22(2,20(23)28-21)15-8-6-10-17(12-15)25-4/h5-12,18-20H,13H2,1-4H3/t18-,19-,20-,21+,22-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50101308
PNG
(CHEMBL3326361)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(13-6-4-8-15(23)10-13)18-22-17(12-25-18)26-21(2,19(22)27-20)14-7-5-9-16(11-14)24-3/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101312
PNG
(CHEMBL3326357)
Show SMILES C[C@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101313
PNG
(CHEMBL3326356)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101311
PNG
(CHEMBL3326358)
Show SMILES C[C@@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13+/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101310
PNG
(CHEMBL3326359)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(OC)c1
Show InChI InChI=1S/C22H25NO5/c1-21(14-7-5-9-16(11-14)24-3)19-23-18(13-26-19)27-22(2,20(23)28-21)15-8-6-10-17(12-15)25-4/h5-12,18-20H,13H2,1-4H3/t18-,19-,20-,21+,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101327
PNG
(CHEMBL3326349)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM21130
PNG
(N-methyl-2-phenyl-N-[(5R,7S,8S)-7-(pyrrolidin-1-yl...)
Show SMILES CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1)C(=O)Cc1ccccc1
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)19-10-12-22(11-7-15-26-22)17-20(19)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101308
PNG
(CHEMBL3326361)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(13-6-4-8-15(23)10-13)18-22-17(12-25-18)26-21(2,19(22)27-20)14-7-5-9-16(11-14)24-3/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101309
PNG
(CHEMBL3326360)
Show SMILES COc1cccc(c1)[C@@]1(C)O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(14-7-5-9-16(11-14)24-3)18-22-17(12-25-18)26-21(2,19(22)27-20)13-6-4-8-15(23)10-13/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101310
PNG
(CHEMBL3326359)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(OC)c1
Show InChI InChI=1S/C22H25NO5/c1-21(14-7-5-9-16(11-14)24-3)19-23-18(13-26-19)27-22(2,20(23)28-21)15-8-6-10-17(12-15)25-4/h5-12,18-20H,13H2,1-4H3/t18-,19-,20-,21+,22-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101311
PNG
(CHEMBL3326358)
Show SMILES C[C@@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101312
PNG
(CHEMBL3326357)
Show SMILES C[C@]1(O[C@H]2CO[C@H]3CO[C@@H]1N23)c1cccc(O)c1
Show InChI InChI=1S/C13H15NO4/c1-13(8-3-2-4-9(15)5-8)12-14-10(6-17-12)16-7-11(14)18-13/h2-5,10-12,15H,6-7H2,1H3/t10-,11-,12-,13-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101313
PNG
(CHEMBL3326356)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101315
PNG
(CHEMBL3326353)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101316
PNG
(CHEMBL3326352)
Show SMILES C[C@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19-,20-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101325
PNG
(CHEMBL3326351)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26+,27+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101326
PNG
(CHEMBL3326350)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27+/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50101327
PNG
(CHEMBL3326349)
Show SMILES C[C@]1(O[C@@H]2N3[C@H]1O[C@](C)([C@@H]3O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C27H27NO6/c1-25(16-7-4-10-19(29)13-16)22-28-23(32-25)26(2,17-8-5-11-20(30)14-17)34-24(28)27(3,33-22)18-9-6-12-21(31)15-18/h4-15,22-24,29-31H,1-3H3/t22-,23-,24-,25-,26-,27-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(MOUSE)
BDBM21130
PNG
(N-methyl-2-phenyl-N-[(5R,7S,8S)-7-(pyrrolidin-1-yl...)
Show SMILES CN([C@H]1CC[C@@]2(CCCO2)C[C@@H]1N1CCCC1)C(=O)Cc1ccccc1
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)19-10-12-22(11-7-15-26-22)17-20(19)24-13-5-6-14-24/h2-4,8-9,19-20H,5-7,10-17H2,1H3/t19-,20-,22-/m0/s1
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>1.00E+3n/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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101308
PNG
(CHEMBL3326361)
Show SMILES COc1cccc(c1)[C@]1(C)O[C@H]2CO[C@@H]3N2[C@H]1O[C@]3(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(13-6-4-8-15(23)10-13)18-22-17(12-25-18)26-21(2,19(22)27-20)14-7-5-9-16(11-14)24-3/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(MOUSE)
BDBM50101309
PNG
(CHEMBL3326360)
Show SMILES COc1cccc(c1)[C@@]1(C)O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1
Show InChI InChI=1S/C21H23NO5/c1-20(14-7-5-9-16(11-14)24-3)18-22-17(12-25-18)26-21(2,19(22)27-20)13-6-4-8-15(23)10-13/h4-11,17-19,23H,12H2,1-3H3/t17-,18-,19-,20+,21-/m0/s1
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>1.00E+3n/an/an/an/an/an/an/an/a



Kitasato University

Curated by ChEMBL


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


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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n/an/an/an/a 98n/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]-GTPgammaS binding


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50101307
PNG
(CHEMBL3326354)
Show SMILES C[C@@]1(O[C@@H]2N3[C@H](CO[C@@H]13)O[C@@]2(C)c1cccc(O)c1)c1cccc(O)c1
Show InChI InChI=1S/C20H21NO5/c1-19(12-5-3-7-14(22)9-12)17-21-16(11-24-17)25-20(2,18(21)26-19)13-6-4-8-15(23)10-13/h3-10,16-18,22-23H,11H2,1-2H3/t16-,17-,18-,19+,20-/m0/s1
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n/an/an/an/a 50n/an/an/an/a



Kitasato University

Curated by ChEMBL


Assay Description
Agonist activity at human kappa opioid receptor expressed in CHO cells assessed as stimulation of [35S]-GTPgammaS binding


ACS Med Chem Lett 5: 868-72 (2014)


Article DOI: 10.1021/ml5000542
BindingDB Entry DOI: 10.7270/Q218388Q
More data for this
Ligand-Target Pair
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