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PubMed code 25193297

Compile data set for download or QSAR
Found 91 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50370067
PNG
(CHEMBL1237164)
Show SMILES Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]45[C@@H](Oc1c24)c1[nH]c2ccccc2c1C[C@@]35O |r,TLB:28:29:7.12.13:4.5.18,30:29:7.12.13:4.5.18|
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-/m1/s1
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0.900n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM21015
PNG
((2S)-2-{2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl...)
Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N(C)[C@@H](Cc1ccccc1)C(=O)NCCO
Show InChI InChI=1S/C26H35N5O6/c1-17(30-25(36)21(27)14-19-8-10-20(33)11-9-19)24(35)29-16-23(34)31(2)22(26(37)28-12-13-32)15-18-6-4-3-5-7-18/h3-11,17,21-22,32-33H,12-16,27H2,1-2H3,(H,28,37)(H,29,35)(H,30,36)/t17-,21+,22+/m1/s1
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2.30n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50159165
PNG
((2S,4aR,6aR,7R,9S,10aS,10bR)-9-(acetyloxy)-2-(fura...)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r|
Show InChI InChI=1S/C23H28O8/c1-12(24)30-16-9-15(20(26)28-4)22(2)7-5-14-21(27)31-17(13-6-8-29-11-13)10-23(14,3)19(22)18(16)25/h6,8,11,14-17,19H,5,7,9-10H2,1-4H3/t14-,15-,16-,17-,19-,22-,23-/m0/s1
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2.90n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025235
PNG
(CHEMBL3330665)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC(C)=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9,13,16-19,22H,1,6,8,10-12H2,2-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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6n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025264
PNG
(CHEMBL3330670)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H32O8/c1-29-13-11-20-28(34)38-23(19-12-14-36-17-19)16-30(20,2)26(29)25(32)22(15-21(29)27(33)35-3)37-24(31)10-9-18-7-5-4-6-8-18/h4-10,12,14,17,20-23,26H,11,13,15-16H2,1-3H3/b10-9+/t20-,21-,22-,23-,26-,29-,30-/s2
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9.60n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025255
PNG
(CHEMBL3330667)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5,8,10,13,15-18,21H,1,6-7,9,11-12H2,2-4H3/t15-,16-,17-,18-,21-,24-,25-/s2
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10n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025277
PNG
(CHEMBL3330683)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccsc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C28H30O8S/c1-27-9-6-18-26(32)36-21(17-7-10-34-14-17)13-28(18,2)24(27)23(30)20(12-19(27)25(31)33-3)35-22(29)5-4-16-8-11-37-15-16/h4-5,7-8,10-11,14-15,18-21,24H,6,9,12-13H2,1-3H3/b5-4+/t18-,19-,20-,21-,24-,27-,28-/s2
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18n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025233
PNG
(CHEMBL3330663)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C24H28O8/c1-5-18(25)31-16-10-15(21(27)29-4)23(2)8-6-14-22(28)32-17(13-7-9-30-12-13)11-24(14,3)20(23)19(16)26/h5,7,9,12,14-17,20H,1,6,8,10-11H2,2-4H3/t14-,15-,16-,17-,20-,23-,24-/s2
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18n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025237
PNG
(CHEMBL3330666)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5-6,8,10,13,15-18,21H,7,9,11-12H2,1-4H3/b6-5+/t15-,16-,17-,18-,21-,24-,25-/s2
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25n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025261
PNG
(CHEMBL3330669)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(C)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13-14,16-19,21H,1,7,9,11-12H2,2-5H3/t14?,16-,17-,18-,19-,21-,25-,26-/s2
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29n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50170670
PNG
((3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dim...)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)C(C)=C)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1
Show InChI InChI=1S/C25H30O8/c1-13(2)21(27)32-17-10-16(22(28)30-5)24(3)8-6-15-23(29)33-18(14-7-9-31-12-14)11-25(15,4)20(24)19(17)26/h7,9,12,15-18,20H,1,6,8,10-11H2,2-5H3/t15-,16-,17-,18-,20-,24-,25-/m0/s1
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34n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025264
PNG
(CHEMBL3330670)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H32O8/c1-29-13-11-20-28(34)38-23(19-12-14-36-17-19)16-30(20,2)26(29)25(32)22(15-21(29)27(33)35-3)37-24(31)10-9-18-7-5-4-6-8-18/h4-10,12,14,17,20-23,26H,11,13,15-16H2,1-3H3/b10-9+/t20-,21-,22-,23-,26-,29-,30-/s2
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52n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025265
PNG
(CHEMBL3330671)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-20-29(35)40-24(19-12-14-38-17-19)16-31(20,2)27(30)26(33)23(15-21(30)28(34)37-4)39-25(32)10-9-18-7-5-6-8-22(18)36-3/h5-10,12,14,17,20-21,23-24,27H,11,13,15-16H2,1-4H3/b10-9+/t20-,21-,23-,24-,27-,30-,31-/s2
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65n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025273
PNG
(CHEMBL3330679)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-8-17-6-4-5-7-19(17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-8+/t20-,21-,22-,23-,26-,29-,30-/s2
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130n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025266
PNG
(CHEMBL3330672)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-21-29(35)40-24(19-12-14-38-17-19)16-31(21,2)27(30)26(33)23(15-22(30)28(34)37-4)39-25(32)10-7-18-5-8-20(36-3)9-6-18/h5-10,12,14,17,21-24,27H,11,13,15-16H2,1-4H3/b10-7+/t21-,22-,23-,24-,27-,30-,31-/s2
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135n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025271
PNG
(CHEMBL3330677)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-19-28(35)41-23(18-11-13-39-16-18)15-30(19,2)26(29)25(33)22(14-20(29)27(34)38-3)40-24(32)9-8-17-6-4-5-7-21(17)31(36)37/h4-9,11,13,16,19-20,22-23,26H,10,12,14-15H2,1-3H3/b9-8+/t19-,20-,22-,23-,26-,29-,30-/s2
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148n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025260
PNG
(CHEMBL3330668)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(\C)=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13,16-19,21H,7,9,11-12H2,1-5H3/b14-6+/t16-,17-,18-,19-,21-,25-,26-/s2
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153n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025268
PNG
(CHEMBL3330674)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-7-18-6-8-20(37-3)14-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-7+/t21-,22-,24-,25-,28-,31-,32-/s2
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162n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025277
PNG
(CHEMBL3330683)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccsc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C28H30O8S/c1-27-9-6-18-26(32)36-21(17-7-10-34-14-17)13-28(18,2)24(27)23(30)20(12-19(27)25(31)33-3)35-22(29)5-4-16-8-11-37-15-16/h4-5,7-8,10-11,14-15,18-21,24H,6,9,12-13H2,1-3H3/b5-4+/t18-,19-,20-,21-,24-,27-,28-/s2
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228n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025272
PNG
(CHEMBL3330678)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-20-28(35)41-23(18-11-13-39-16-18)15-30(20,2)26(29)25(33)22(14-21(29)27(34)38-3)40-24(32)9-6-17-4-7-19(8-5-17)31(36)37/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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281n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025234
PNG
(CHEMBL3330664)
Show SMILES [H][C@@]12[#6]-[#6][C@@]3([#6])[#6@@H](-[#6]-[#6@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6](=O)[C@]3([H])[C@@]1([#6])[#6]-[#6@H](-[#8]-[#6]2=O)-c1ccoc1)-[#6](=O)-[#8]-[#6] |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9-10,13,16-19,22H,6,8,11-12H2,1-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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284n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025277
PNG
(CHEMBL3330683)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccsc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C28H30O8S/c1-27-9-6-18-26(32)36-21(17-7-10-34-14-17)13-28(18,2)24(27)23(30)20(12-19(27)25(31)33-3)35-22(29)5-4-16-8-11-37-15-16/h4-5,7-8,10-11,14-15,18-21,24H,6,9,12-13H2,1-3H3/b5-4+/t18-,19-,20-,21-,24-,27-,28-/s2
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304n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025270
PNG
(CHEMBL3330676)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc5OCOc5c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H32O10/c1-30-10-8-19-29(35)41-24(18-9-11-37-15-18)14-31(19,2)27(30)26(33)23(13-20(30)28(34)36-3)40-25(32)7-5-17-4-6-21-22(12-17)39-16-38-21/h4-7,9,11-12,15,19-20,23-24,27H,8,10,13-14,16H2,1-3H3/b7-5+/t19-,20-,23-,24-,27-,30-,31-/s2
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323n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025276
PNG
(CHEMBL3330682)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cccnc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C29H31NO8/c1-28-10-8-19-27(34)38-22(18-9-12-36-16-18)14-29(19,2)25(28)24(32)21(13-20(28)26(33)35-3)37-23(31)7-6-17-5-4-11-30-15-17/h4-7,9,11-12,15-16,19-22,25H,8,10,13-14H2,1-3H3/b7-6+/t19-,20-,21-,22-,25-,28-,29-/s2
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334n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025235
PNG
(CHEMBL3330665)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC(C)=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9,13,16-19,22H,1,6,8,10-12H2,2-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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362n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025234
PNG
(CHEMBL3330664)
Show SMILES [H][C@@]12[#6]-[#6][C@@]3([#6])[#6@@H](-[#6]-[#6@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6](=O)[C@]3([H])[C@@]1([#6])[#6]-[#6@H](-[#8]-[#6]2=O)-c1ccoc1)-[#6](=O)-[#8]-[#6] |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9-10,13,16-19,22H,6,8,11-12H2,1-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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385n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025261
PNG
(CHEMBL3330669)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(C)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13-14,16-19,21H,1,7,9,11-12H2,2-5H3/t14?,16-,17-,18-,19-,21-,25-,26-/s2
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439n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025237
PNG
(CHEMBL3330666)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5-6,8,10,13,15-18,21H,7,9,11-12H2,1-4H3/b6-5+/t15-,16-,17-,18-,21-,24-,25-/s2
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540n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025267
PNG
(CHEMBL3330673)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)ccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-6-18-14-20(37-3)7-8-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-6+/t21-,22-,24-,25-,28-,31-,32-/s2
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581n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025264
PNG
(CHEMBL3330670)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H32O8/c1-29-13-11-20-28(34)38-23(19-12-14-36-17-19)16-30(20,2)26(29)25(32)22(15-21(29)27(33)35-3)37-24(31)10-9-18-7-5-4-6-8-18/h4-10,12,14,17,20-23,26H,11,13,15-16H2,1-3H3/b10-9+/t20-,21-,22-,23-,26-,29-,30-/s2
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701n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025233
PNG
(CHEMBL3330663)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C24H28O8/c1-5-18(25)31-16-10-15(21(27)29-4)23(2)8-6-14-22(28)32-17(13-7-9-30-12-13)11-24(14,3)20(23)19(16)26/h5,7,9,12,14-17,20H,1,6,8,10-11H2,2-4H3/t14-,15-,16-,17-,20-,23-,24-/s2
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979n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025255
PNG
(CHEMBL3330667)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5,8,10,13,15-18,21H,1,6-7,9,11-12H2,2-4H3/t15-,16-,17-,18-,21-,24-,25-/s2
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1.44E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025234
PNG
(CHEMBL3330664)
Show SMILES [H][C@@]12[#6]-[#6][C@@]3([#6])[#6@@H](-[#6]-[#6@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6](=O)[C@]3([H])[C@@]1([#6])[#6]-[#6@H](-[#8]-[#6]2=O)-c1ccoc1)-[#6](=O)-[#8]-[#6] |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9-10,13,16-19,22H,6,8,11-12H2,1-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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2.63E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025270
PNG
(CHEMBL3330676)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc5OCOc5c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H32O10/c1-30-10-8-19-29(35)41-24(18-9-11-37-15-18)14-31(19,2)27(30)26(33)23(13-20(30)28(34)36-3)40-25(32)7-5-17-4-6-21-22(12-17)39-16-38-21/h4-7,9,11-12,15,19-20,23-24,27H,8,10,13-14,16H2,1-3H3/b7-5+/t19-,20-,23-,24-,27-,30-,31-/s2
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2.82E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025261
PNG
(CHEMBL3330669)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(C)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13-14,16-19,21H,1,7,9,11-12H2,2-5H3/t14?,16-,17-,18-,19-,21-,25-,26-/s2
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3.03E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025255
PNG
(CHEMBL3330667)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5,8,10,13,15-18,21H,1,6-7,9,11-12H2,2-4H3/t15-,16-,17-,18-,21-,24-,25-/s2
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3.26E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025276
PNG
(CHEMBL3330682)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cccnc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C29H31NO8/c1-28-10-8-19-27(34)38-22(18-9-12-36-16-18)14-29(19,2)25(28)24(32)21(13-20(28)26(33)35-3)37-23(31)7-6-17-5-4-11-30-15-17/h4-7,9,11-12,15-16,19-22,25H,8,10,13-14H2,1-3H3/b7-6+/t19-,20-,21-,22-,25-,28-,29-/s2
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4.89E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025275
PNG
(CHEMBL3330681)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(ccc4C(F)(F)F)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H30F6O8/c1-29-10-8-20-28(42)46-23(17-9-11-44-15-17)14-30(20,2)26(29)25(40)22(13-21(29)27(41)43-3)45-24(39)7-4-16-12-18(31(33,34)35)5-6-19(16)32(36,37)38/h4-7,9,11-12,15,20-23,26H,8,10,13-14H2,1-3H3/b7-4+/t20-,21-,22-,23-,26-,29-,30-/s2
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5.87E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50170670
PNG
((3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dim...)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)C(C)=C)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1
Show InChI InChI=1S/C25H30O8/c1-13(2)21(27)32-17-10-16(22(28)30-5)24(3)8-6-15-23(29)33-18(14-7-9-31-12-14)11-25(15,4)20(24)19(17)26/h7,9,12,15-18,20H,1,6,8,10-11H2,2-5H3/t15-,16-,17-,18-,20-,24-,25-/m0/s1
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7.82E+3n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025274
PNG
(CHEMBL3330680)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-6-17-4-7-19(8-5-17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025260
PNG
(CHEMBL3330668)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(\C)=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13,16-19,21H,7,9,11-12H2,1-5H3/b14-6+/t16-,17-,18-,19-,21-,25-,26-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025233
PNG
(CHEMBL3330663)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C24H28O8/c1-5-18(25)31-16-10-15(21(27)29-4)23(2)8-6-14-22(28)32-17(13-7-9-30-12-13)11-24(14,3)20(23)19(16)26/h5,7,9,12,14-17,20H,1,6,8,10-11H2,2-4H3/t14-,15-,16-,17-,20-,23-,24-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025275
PNG
(CHEMBL3330681)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(ccc4C(F)(F)F)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H30F6O8/c1-29-10-8-20-28(42)46-23(17-9-11-44-15-17)14-30(20,2)26(29)25(40)22(13-21(29)27(41)43-3)45-24(39)7-4-16-12-18(31(33,34)35)5-6-19(16)32(36,37)38/h4-7,9,11-12,15,20-23,26H,8,10,13-14H2,1-3H3/b7-4+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025274
PNG
(CHEMBL3330680)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-6-17-4-7-19(8-5-17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025269
PNG
(CHEMBL3330675)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)c(OC)c(OC)c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C33H38O11/c1-32-11-9-20-31(37)44-25(19-10-12-42-17-19)16-33(20,2)29(32)27(35)22(15-21(32)30(36)41-6)43-26(34)8-7-18-13-23(38-3)28(40-5)24(14-18)39-4/h7-8,10,12-14,17,20-22,25,29H,9,11,15-16H2,1-6H3/b8-7+/t20-,21-,22-,25-,29-,32-,33-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025260
PNG
(CHEMBL3330668)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(\C)=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13,16-19,21H,7,9,11-12H2,1-5H3/b14-6+/t16-,17-,18-,19-,21-,25-,26-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025265
PNG
(CHEMBL3330671)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-20-29(35)40-24(19-12-14-38-17-19)16-31(20,2)27(30)26(33)23(15-21(30)28(34)37-4)39-25(32)10-9-18-7-5-6-8-22(18)36-3/h5-10,12,14,17,20-21,23-24,27H,11,13,15-16H2,1-4H3/b10-9+/t20-,21-,23-,24-,27-,30-,31-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025267
PNG
(CHEMBL3330673)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)ccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-6-18-14-20(37-3)7-8-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-6+/t21-,22-,24-,25-,28-,31-,32-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025270
PNG
(CHEMBL3330676)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc5OCOc5c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H32O10/c1-30-10-8-19-29(35)41-24(18-9-11-37-15-18)14-31(19,2)27(30)26(33)23(13-20(30)28(34)36-3)40-25(32)7-5-17-4-6-21-22(12-17)39-16-38-21/h4-7,9,11-12,15,19-20,23-24,27H,8,10,13-14,16H2,1-3H3/b7-5+/t19-,20-,23-,24-,27-,30-,31-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025274
PNG
(CHEMBL3330680)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-6-17-4-7-19(8-5-17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025276
PNG
(CHEMBL3330682)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cccnc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C29H31NO8/c1-28-10-8-19-27(34)38-22(18-9-12-36-16-18)14-29(19,2)25(28)24(32)21(13-20(28)26(33)35-3)37-23(31)7-6-17-5-4-11-30-15-17/h4-7,9,11-12,15-16,19-22,25H,8,10,13-14H2,1-3H3/b7-6+/t19-,20-,21-,22-,25-,28-,29-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025268
PNG
(CHEMBL3330674)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-7-18-6-8-20(37-3)14-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-7+/t21-,22-,24-,25-,28-,31-,32-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025269
PNG
(CHEMBL3330675)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)c(OC)c(OC)c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C33H38O11/c1-32-11-9-20-31(37)44-25(19-10-12-42-17-19)16-33(20,2)29(32)27(35)22(15-21(32)30(36)41-6)43-26(34)8-7-18-13-23(38-3)28(40-5)24(14-18)39-4/h7-8,10,12-14,17,20-22,25,29H,9,11,15-16H2,1-6H3/b8-7+/t20-,21-,22-,25-,29-,32-,33-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50170670
PNG
((3S,4aR,4bS,6S,8R,8aR,10aR)-3-Furan-3-yl-4a,8a-dim...)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(=O)C(C)=C)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1
Show InChI InChI=1S/C25H30O8/c1-13(2)21(27)32-17-10-16(22(28)30-5)24(3)8-6-15-23(29)33-18(14-7-9-31-12-14)11-25(15,4)20(24)19(17)26/h7,9,12,15-18,20H,1,6,8,10-11H2,2-5H3/t15-,16-,17-,18-,20-,24-,25-/m0/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025237
PNG
(CHEMBL3330666)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5-6,8,10,13,15-18,21H,7,9,11-12H2,1-4H3/b6-5+/t15-,16-,17-,18-,21-,24-,25-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025266
PNG
(CHEMBL3330672)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-21-29(35)40-24(19-12-14-38-17-19)16-31(21,2)27(30)26(33)23(15-22(30)28(34)37-4)39-25(32)10-7-18-5-8-20(36-3)9-6-18/h5-10,12,14,17,21-24,27H,11,13,15-16H2,1-4H3/b10-7+/t21-,22-,23-,24-,27-,30-,31-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025275
PNG
(CHEMBL3330681)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(ccc4C(F)(F)F)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H30F6O8/c1-29-10-8-20-28(42)46-23(17-9-11-44-15-17)14-30(20,2)26(29)25(40)22(13-21(29)27(41)43-3)45-24(39)7-4-16-12-18(31(33,34)35)5-6-19(16)32(36,37)38/h4-7,9,11-12,15,20-23,26H,8,10,13-14H2,1-3H3/b7-4+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025273
PNG
(CHEMBL3330679)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-8-17-6-4-5-7-19(17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-8+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025272
PNG
(CHEMBL3330678)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-20-28(35)41-23(18-11-13-39-16-18)15-30(20,2)26(29)25(33)22(14-21(29)27(34)38-3)40-24(32)9-6-17-4-7-19(8-5-17)31(36)37/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025265
PNG
(CHEMBL3330671)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-20-29(35)40-24(19-12-14-38-17-19)16-31(20,2)27(30)26(33)23(15-21(30)28(34)37-4)39-25(32)10-9-18-7-5-6-8-22(18)36-3/h5-10,12,14,17,20-21,23-24,27H,11,13,15-16H2,1-4H3/b10-9+/t20-,21-,23-,24-,27-,30-,31-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025271
PNG
(CHEMBL3330677)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-19-28(35)41-23(18-11-13-39-16-18)15-30(19,2)26(29)25(33)22(14-20(29)27(34)38-3)40-24(32)9-8-17-6-4-5-7-21(17)31(36)37/h4-9,11,13,16,19-20,22-23,26H,10,12,14-15H2,1-3H3/b9-8+/t19-,20-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025272
PNG
(CHEMBL3330678)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-20-28(35)41-23(18-11-13-39-16-18)15-30(20,2)26(29)25(33)22(14-21(29)27(34)38-3)40-24(32)9-6-17-4-7-19(8-5-17)31(36)37/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025269
PNG
(CHEMBL3330675)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)c(OC)c(OC)c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C33H38O11/c1-32-11-9-20-31(37)44-25(19-10-12-42-17-19)16-33(20,2)29(32)27(35)22(15-21(32)30(36)41-6)43-26(34)8-7-18-13-23(38-3)28(40-5)24(14-18)39-4/h7-8,10,12-14,17,20-22,25,29H,9,11,15-16H2,1-6H3/b8-7+/t20-,21-,22-,25-,29-,32-,33-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]U69593 from kappa opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025271
PNG
(CHEMBL3330677)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-19-28(35)41-23(18-11-13-39-16-18)15-30(19,2)26(29)25(33)22(14-20(29)27(34)38-3)40-24(32)9-8-17-6-4-5-7-21(17)31(36)37/h4-9,11,13,16,19-20,22-23,26H,10,12,14-15H2,1-3H3/b9-8+/t19-,20-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025267
PNG
(CHEMBL3330673)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)ccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-6-18-14-20(37-3)7-8-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-6+/t21-,22-,24-,25-,28-,31-,32-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025273
PNG
(CHEMBL3330679)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-8-17-6-4-5-7-19(17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-8+/t20-,21-,22-,23-,26-,29-,30-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50025266
PNG
(CHEMBL3330672)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-21-29(35)40-24(19-12-14-38-17-19)16-31(21,2)27(30)26(33)23(15-22(30)28(34)37-4)39-25(32)10-7-18-5-8-20(36-3)9-6-18/h5-10,12,14,17,21-24,27H,11,13,15-16H2,1-4H3/b10-7+/t21-,22-,23-,24-,27-,30-,31-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from mu opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025235
PNG
(CHEMBL3330665)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC(C)=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9,13,16-19,22H,1,6,8,10-12H2,2-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50025268
PNG
(CHEMBL3330674)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-7-18-6-8-20(37-3)14-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-7+/t21-,22-,24-,25-,28-,31-,32-/s2
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>1.00E+4n/an/an/an/an/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from delta opioid receptor (unknown origin) expressed in HEK293T cells after 1.5 hrs by radioligand binding assay


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025233
PNG
(CHEMBL3330663)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C24H28O8/c1-5-18(25)31-16-10-15(21(27)29-4)23(2)8-6-14-22(28)32-17(13-7-9-30-12-13)11-24(14,3)20(23)19(16)26/h5,7,9,12,14-17,20H,1,6,8,10-11H2,2-4H3/t14-,15-,16-,17-,20-,23-,24-/s2
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n/an/an/an/a 137n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025235
PNG
(CHEMBL3330665)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC(C)=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9,13,16-19,22H,1,6,8,10-12H2,2-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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n/an/an/an/a 25n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025237
PNG
(CHEMBL3330666)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5-6,8,10,13,15-18,21H,7,9,11-12H2,1-4H3/b6-5+/t15-,16-,17-,18-,21-,24-,25-/s2
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n/an/an/an/a 11n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025261
PNG
(CHEMBL3330669)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(C)C=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13-14,16-19,21H,1,7,9,11-12H2,2-5H3/t14?,16-,17-,18-,19-,21-,25-,26-/s2
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n/an/an/an/a 37n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025264
PNG
(CHEMBL3330670)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H32O8/c1-29-13-11-20-28(34)38-23(19-12-14-36-17-19)16-30(20,2)26(29)25(32)22(15-21(29)27(33)35-3)37-24(31)10-9-18-7-5-4-6-8-18/h4-10,12,14,17,20-23,26H,11,13,15-16H2,1-3H3/b10-9+/t20-,21-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 7n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025260
PNG
(CHEMBL3330668)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)C(\C)=C\C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C26H32O8/c1-6-14(2)22(28)33-18-11-17(23(29)31-5)25(3)9-7-16-24(30)34-19(15-8-10-32-13-15)12-26(16,4)21(25)20(18)27/h6,8,10,13,16-19,21H,7,9,11-12H2,1-5H3/b14-6+/t16-,17-,18-,19-,21-,25-,26-/s2
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n/an/an/an/a 477n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025265
PNG
(CHEMBL3330671)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-20-29(35)40-24(19-12-14-38-17-19)16-31(20,2)27(30)26(33)23(15-21(30)28(34)37-4)39-25(32)10-9-18-7-5-6-8-22(18)36-3/h5-10,12,14,17,20-21,23-24,27H,11,13,15-16H2,1-4H3/b10-9+/t20-,21-,23-,24-,27-,30-,31-/s2
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n/an/an/an/a 10n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025266
PNG
(CHEMBL3330672)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H34O9/c1-30-13-11-21-29(35)40-24(19-12-14-38-17-19)16-31(21,2)27(30)26(33)23(15-22(30)28(34)37-4)39-25(32)10-7-18-5-8-20(36-3)9-6-18/h5-10,12,14,17,21-24,27H,11,13,15-16H2,1-4H3/b10-7+/t21-,22-,23-,24-,27-,30-,31-/s2
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n/an/an/an/a 21n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025274
PNG
(CHEMBL3330680)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-6-17-4-7-19(8-5-17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 642n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50159165
PNG
((2S,4aR,6aR,7R,9S,10aS,10bR)-9-(acetyloxy)-2-(fura...)
Show SMILES COC(=O)[C@@H]1C[C@H](OC(C)=O)C(=O)[C@H]2[C@@]1(C)CC[C@H]1C(=O)O[C@@H](C[C@]21C)c1ccoc1 |r|
Show InChI InChI=1S/C23H28O8/c1-12(24)30-16-9-15(20(26)28-4)22(2)7-5-14-21(27)31-17(13-6-8-29-11-13)10-23(14,3)19(22)18(16)25/h6,8,11,14-17,19H,5,7,9-10H2,1-4H3/t14-,15-,16-,17-,19-,22-,23-/m0/s1
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n/an/an/an/a 0.360n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025269
PNG
(CHEMBL3330675)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)c(OC)c(OC)c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C33H38O11/c1-32-11-9-20-31(37)44-25(19-10-12-42-17-19)16-33(20,2)29(32)27(35)22(15-21(32)30(36)41-6)43-26(34)8-7-18-13-23(38-3)28(40-5)24(14-18)39-4/h7-8,10,12-14,17,20-22,25,29H,9,11,15-16H2,1-6H3/b8-7+/t20-,21-,22-,25-,29-,32-,33-/s2
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n/an/an/an/a 1.80E+3n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025275
PNG
(CHEMBL3330681)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(ccc4C(F)(F)F)C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H30F6O8/c1-29-10-8-20-28(42)46-23(17-9-11-44-15-17)14-30(20,2)26(29)25(40)22(13-21(29)27(41)43-3)45-24(39)7-4-16-12-18(31(33,34)35)5-6-19(16)32(36,37)38/h4-7,9,11-12,15,20-23,26H,8,10,13-14H2,1-3H3/b7-4+/t20-,21-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 1.21E+3n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025272
PNG
(CHEMBL3330678)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(cc4)[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-20-28(35)41-23(18-11-13-39-16-18)15-30(20,2)26(29)25(33)22(14-21(29)27(34)38-3)40-24(32)9-6-17-4-7-19(8-5-17)31(36)37/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-6+/t20-,21-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 32n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025267
PNG
(CHEMBL3330673)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cc(OC)ccc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-6-18-14-20(37-3)7-8-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-6+/t21-,22-,24-,25-,28-,31-,32-/s2
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n/an/an/an/a 38n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025270
PNG
(CHEMBL3330676)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc5OCOc5c4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H32O10/c1-30-10-8-19-29(35)41-24(18-9-11-37-15-18)14-31(19,2)27(30)26(33)23(13-20(30)28(34)36-3)40-25(32)7-5-17-4-6-21-22(12-17)39-16-38-21/h4-7,9,11-12,15,19-20,23-24,27H,8,10,13-14,16H2,1-3H3/b7-5+/t19-,20-,23-,24-,27-,30-,31-/s2
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n/an/an/an/a 50n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025277
PNG
(CHEMBL3330683)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccsc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C28H30O8S/c1-27-9-6-18-26(32)36-21(17-7-10-34-14-17)13-28(18,2)24(27)23(30)20(12-19(27)25(31)33-3)35-22(29)5-4-16-8-11-37-15-16/h4-5,7-8,10-11,14-15,18-21,24H,6,9,12-13H2,1-3H3/b5-4+/t18-,19-,20-,21-,24-,27-,28-/s2
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n/an/an/an/a 582n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025273
PNG
(CHEMBL3330679)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4C(F)(F)F)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C31H31F3O8/c1-29-12-10-20-28(38)42-23(18-11-13-40-16-18)15-30(20,2)26(29)25(36)22(14-21(29)27(37)39-3)41-24(35)9-8-17-6-4-5-7-19(17)31(32,33)34/h4-9,11,13,16,20-23,26H,10,12,14-15H2,1-3H3/b9-8+/t20-,21-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 20n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025255
PNG
(CHEMBL3330667)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)CC=C)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C25H30O8/c1-5-6-19(26)32-17-11-16(22(28)30-4)24(2)9-7-15-23(29)33-18(14-8-10-31-13-14)12-25(15,3)21(24)20(17)27/h5,8,10,13,15-18,21H,1,6-7,9,11-12H2,2-4H3/t15-,16-,17-,18-,21-,24-,25-/s2
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n/an/an/an/a 23n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025268
PNG
(CHEMBL3330674)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccc(OC)cc4OC)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C32H36O10/c1-31-12-10-21-30(36)42-25(19-11-13-40-17-19)16-32(21,2)28(31)27(34)24(15-22(31)29(35)39-5)41-26(33)9-7-18-6-8-20(37-3)14-23(18)38-4/h6-9,11,13-14,17,21-22,24-25,28H,10,12,15-16H2,1-5H3/b9-7+/t21-,22-,24-,25-,28-,31-,32-/s2
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n/an/an/an/a 27n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025271
PNG
(CHEMBL3330677)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4ccccc4[N+]([O-])=O)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C30H31NO10/c1-29-12-10-19-28(35)41-23(18-11-13-39-16-18)15-30(19,2)26(29)25(33)22(14-20(29)27(34)38-3)40-24(32)9-8-17-6-4-5-7-21(17)31(36)37/h4-9,11,13,16,19-20,22-23,26H,10,12,14-15H2,1-3H3/b9-8+/t19-,20-,22-,23-,26-,29-,30-/s2
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n/an/an/an/a 33n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025276
PNG
(CHEMBL3330682)
Show SMILES [H][C@@]12CC[C@@]3(C)[C@@H](C[C@H](OC(=O)\C=C\c4cccnc4)C(=O)[C@]3([H])[C@@]1(C)C[C@H](OC2=O)c1ccoc1)C(=O)OC |r|
Show InChI InChI=1/C29H31NO8/c1-28-10-8-19-27(34)38-22(18-9-12-36-16-18)14-29(19,2)25(28)24(32)21(13-20(28)26(33)35-3)37-23(31)7-6-17-5-4-11-30-15-17/h4-7,9,11-12,15-16,19-22,25H,8,10,13-14H2,1-3H3/b7-6+/t19-,20-,21-,22-,25-,28-,29-/s2
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n/an/an/an/a 1.76E+3n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50025234
PNG
(CHEMBL3330664)
Show SMILES [H][C@@]12[#6]-[#6][C@@]3([#6])[#6@@H](-[#6]-[#6@H](-[#8]-[#6](=O)\[#6]=[#6](\[#6])-[#6])-[#6](=O)[C@]3([H])[C@@]1([#6])[#6]-[#6@H](-[#8]-[#6]2=O)-c1ccoc1)-[#6](=O)-[#8]-[#6] |r|
Show InChI InChI=1/C26H32O8/c1-14(2)10-20(27)33-18-11-17(23(29)31-5)25(3)8-6-16-24(30)34-19(15-7-9-32-13-15)12-26(16,4)22(25)21(18)28/h7,9-10,13,16-19,22H,6,8,11-12H2,1-5H3/t16-,17-,18-,19-,22-,25-,26-/s2
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n/an/an/an/a 698n/an/an/an/a



University of Mississippi

Curated by ChEMBL


Assay Description
Inhibition of human kappa opioid receptor expressed in HEK293T cells assessed as inhibition of cAMP production after 30 mins


Eur J Med Chem 85: 818-29 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.077
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%