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PubMed code 25599950

Compile data set for download or QSAR
Found 79 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
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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1.20n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072322
PNG
(CHEMBL3409106)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C24H29NO2/c26-20-10-11-22-21(15-20)24(12-4-7-18-5-2-1-3-6-18)13-14-25(16-19-8-9-19)17-23(24)27-22/h1-3,5-6,10-11,15,19,23,26H,4,7-9,12-14,16-17H2/t23-,24-/s2
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1.40n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072341
PNG
(CHEMBL3409114)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/s2
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1.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072331
PNG
(CHEMBL3409121)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)25-12-10-24(11-13-25)16-19-35-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(36)14-15-28(27)37-29(30)22-35/h1,3-4,7-8,10-15,21,29,36H,2,5-6,9,16-20,22H2/t29-,30-/s2
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3.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)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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3.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072330
PNG
(CHEMBL3409122)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C26H33NO2/c28-22-12-13-24-23(17-22)26(14-6-2-5-9-20-7-3-1-4-8-20)15-16-27(18-21-10-11-21)19-25(26)29-24/h1,3-4,7-8,12-13,17,21,25,28H,2,5-6,9-11,14-16,18-19H2/t25-,26-/s2
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3.70n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072342
PNG
(CHEMBL3409113)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-9-23(10-12-24)15-18-34-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(35)13-14-27(26)36-28(29)21-34/h1-3,6-7,9-14,20,28,35H,4-5,8,15-19,21H2/t28-,29-/s2
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3.80n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072330
PNG
(CHEMBL3409122)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C26H33NO2/c28-22-12-13-24-23(17-22)26(14-6-2-5-9-20-7-3-1-4-8-20)15-16-27(18-21-10-11-21)19-25(26)29-24/h1,3-4,7-8,12-13,17,21,25,28H,2,5-6,9-11,14-16,18-19H2/t25-,26-/s2
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3.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072333
PNG
(CHEMBL3409119)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-25-12-10-24(11-13-25)16-19-32-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(33)14-15-28(27)34-29(30)22-32/h1,3-4,7-8,10-15,21,29,33H,2,5-6,9,16-20,22H2/t29-,30-/s2
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4.20n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/s2
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5.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072322
PNG
(CHEMBL3409106)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C24H29NO2/c26-20-10-11-22-21(15-20)24(12-4-7-18-5-2-1-3-6-18)13-14-25(16-19-8-9-19)17-23(24)27-22/h1-3,5-6,10-11,15,19,23,26H,4,7-9,12-14,16-17H2/t23-,24-/s2
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5.5n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072334
PNG
(CHEMBL3409118)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/s2
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5.60n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072332
PNG
(CHEMBL3409120)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-27-13-7-6-12-24(27)16-19-32-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)26-21-25(33)14-15-28(26)34-29(30)22-32/h1,3-4,6-7,9-10,12-15,21,29,33H,2,5,8,11,16-20,22H2/t29-,30-/s2
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5.80n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072328
PNG
(CHEMBL3409100)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H31NO2/c30-24-13-14-26-25(20-24)28(16-7-12-22-8-3-1-4-9-22)17-19-29(21-27(28)31-26)18-15-23-10-5-2-6-11-23/h1-6,8-11,13-14,20,27,30H,7,12,15-19,21H2/t27-,28-/s2
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6.90n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072325
PNG
(CHEMBL3409103)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-15-16-27-26(21-25)29(17-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-8-14-24-11-5-2-6-12-24/h1-6,9-12,15-16,21,28,31H,7-8,13-14,17-20,22H2/t28-,29-/s2
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7.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072346
PNG
(CHEMBL3409109)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-14-15-27-26(21-25)29(17-8-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-16-24-11-5-2-6-12-24/h1-6,9-12,14-15,21,28,31H,7-8,13,16-20,22H2/t28-,29-/s2
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7.30n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072346
PNG
(CHEMBL3409109)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-14-15-27-26(21-25)29(17-8-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-16-24-11-5-2-6-12-24/h1-6,9-12,14-15,21,28,31H,7-8,13,16-20,22H2/t28-,29-/s2
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7.70n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/s2
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9.10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072344
PNG
(CHEMBL3409111)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-26-12-5-4-11-23(26)15-18-31-19-17-29(16-7-6-10-22-8-2-1-3-9-22)25-20-24(32)13-14-27(25)33-28(29)21-31/h1-5,8-9,11-14,20,28,32H,6-7,10,15-19,21H2/t28-,29-/s2
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10n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072345
PNG
(CHEMBL3409110)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-24-11-9-23(10-12-24)15-18-31-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(32)13-14-27(26)33-28(29)21-31/h1-3,6-7,9-14,20,28,32H,4-5,8,15-19,21H2/t28-,29-/s2
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12n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072322
PNG
(CHEMBL3409106)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C24H29NO2/c26-20-10-11-22-21(15-20)24(12-4-7-18-5-2-1-3-6-18)13-14-25(16-19-8-9-19)17-23(24)27-22/h1-3,5-6,10-11,15,19,23,26H,4,7-9,12-14,16-17H2/t23-,24-/s2
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13n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072326
PNG
(CHEMBL3409102)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-25-11-5-4-10-22(25)14-17-30-18-16-28(15-6-9-21-7-2-1-3-8-21)24-19-23(31)12-13-26(24)32-27(28)20-30/h1-5,7-8,10-13,19,27,31H,6,9,14-18,20H2/t27-,28-/s2
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13n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072341
PNG
(CHEMBL3409114)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/s2
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14n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072328
PNG
(CHEMBL3409100)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H31NO2/c30-24-13-14-26-25(20-24)28(16-7-12-22-8-3-1-4-9-22)17-19-29(21-27(28)31-26)18-15-23-10-5-2-6-11-23/h1-6,8-11,13-14,20,27,30H,7,12,15-19,21H2/t27-,28-/s2
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14n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072327
PNG
(CHEMBL3409101)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-23-10-8-22(9-11-23)14-17-30-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(31)12-13-26(25)32-27(28)20-30/h1-3,5-6,8-13,19,27,31H,4,7,14-18,20H2/t27-,28-/s2
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15n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072341
PNG
(CHEMBL3409114)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C25H31NO2/c27-21-11-12-23-22(16-21)25(13-5-4-8-19-6-2-1-3-7-19)14-15-26(17-20-9-10-20)18-24(25)28-23/h1-3,6-7,11-12,16,20,24,27H,4-5,8-10,13-15,17-18H2/t24-,25-/s2
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16n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072326
PNG
(CHEMBL3409102)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-25-11-5-4-10-22(25)14-17-30-18-16-28(15-6-9-21-7-2-1-3-8-21)24-19-23(31)12-13-26(24)32-27(28)20-30/h1-5,7-8,10-13,19,27,31H,6,9,14-18,20H2/t27-,28-/s2
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17n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072324
PNG
(CHEMBL3409104)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-8-22(9-11-23)14-17-33-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(34)12-13-26(25)35-27(28)20-33/h1-3,5-6,8-13,19,27,34H,4,7,14-18,20H2/t27-,28-/s2
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18n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072342
PNG
(CHEMBL3409113)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-9-23(10-12-24)15-18-34-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(35)13-14-27(26)36-28(29)21-34/h1-3,6-7,9-14,20,28,35H,4-5,8,15-19,21H2/t28-,29-/s2
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21n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072345
PNG
(CHEMBL3409110)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-24-11-9-23(10-12-24)15-18-31-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(32)13-14-27(26)33-28(29)21-31/h1-3,6-7,9-14,20,28,32H,4-5,8,15-19,21H2/t28-,29-/s2
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21n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072330
PNG
(CHEMBL3409122)
Show SMILES [H][C@]12CN(CC3CC3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C26H33NO2/c28-22-12-13-24-23(17-22)26(14-6-2-5-9-20-7-3-1-4-8-20)15-16-27(18-21-10-11-21)19-25(26)29-24/h1,3-4,7-8,12-13,17,21,25,28H,2,5-6,9-11,14-16,18-19H2/t25-,26-/s2
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24n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072334
PNG
(CHEMBL3409118)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/s2
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25n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072344
PNG
(CHEMBL3409111)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-26-12-5-4-11-23(26)15-18-31-19-17-29(16-7-6-10-22-8-2-1-3-9-22)25-20-24(32)13-14-27(25)33-28(29)21-31/h1-5,8-9,11-14,20,28,32H,6-7,10,15-19,21H2/t28-,29-/s2
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26n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072324
PNG
(CHEMBL3409104)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-8-22(9-11-23)14-17-33-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(34)12-13-26(25)35-27(28)20-33/h1-3,5-6,8-13,19,27,34H,4,7,14-18,20H2/t27-,28-/s2
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27n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072335
PNG
(CHEMBL3409117)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-6-10-23(19-24)14-17-34-18-16-29(15-5-4-9-22-7-2-1-3-8-22)26-20-25(35)12-13-27(26)36-28(29)21-34/h1-3,6-8,10-13,19-20,28,35H,4-5,9,14-18,21H2/t28-,29-/s2
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38n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072333
PNG
(CHEMBL3409119)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-25-12-10-24(11-13-25)16-19-32-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(33)14-15-28(27)34-29(30)22-32/h1,3-4,7-8,10-15,21,29,33H,2,5-6,9,16-20,22H2/t29-,30-/s2
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44n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072327
PNG
(CHEMBL3409101)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-23-10-8-22(9-11-23)14-17-30-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(31)12-13-26(25)32-27(28)20-30/h1-3,5-6,8-13,19,27,31H,4,7,14-18,20H2/t27-,28-/s2
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47n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072323
PNG
(CHEMBL3409105)
Show SMILES [H][C@]12CN(CC=C)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C23H27NO2/c1-2-14-24-15-13-23(12-6-9-18-7-4-3-5-8-18)20-16-19(25)10-11-21(20)26-22(23)17-24/h2-5,7-8,10-11,16,22,25H,1,6,9,12-15,17H2/t22-,23-/s2
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53n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072332
PNG
(CHEMBL3409120)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-27-13-7-6-12-24(27)16-19-32-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)26-21-25(33)14-15-28(26)34-29(30)22-32/h1,3-4,6-7,9-10,12-15,21,29,33H,2,5,8,11,16-20,22H2/t29-,30-/s2
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54n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072343
PNG
(CHEMBL3409112)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-16-17-28-27(22-26)30(18-8-7-14-24-10-3-1-4-11-24)19-21-31(23-29(30)33-28)20-9-15-25-12-5-2-6-13-25/h1-6,10-13,16-17,22,29,32H,7-9,14-15,18-21,23H2/t29-,30-/s2
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57n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072348
PNG
(CHEMBL3409116)
Show SMILES [H][C@]12CN(CCCCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H37NO2/c33-27-17-18-29-28(23-27)31(19-9-7-15-25-11-3-1-4-12-25)20-22-32(24-30(31)34-29)21-10-8-16-26-13-5-2-6-14-26/h1-6,11-14,17-18,23,30,33H,7-10,15-16,19-22,24H2/t30-,31-/s2
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68n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072325
PNG
(CHEMBL3409103)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-15-16-27-26(21-25)29(17-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-8-14-24-11-5-2-6-12-24/h1-6,9-12,15-16,21,28,31H,7-8,13-14,17-20,22H2/t28-,29-/s2
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73n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072343
PNG
(CHEMBL3409112)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-16-17-28-27(22-26)30(18-8-7-14-24-10-3-1-4-11-24)19-21-31(23-29(30)33-28)20-9-15-25-12-5-2-6-13-25/h1-6,10-13,16-17,22,29,32H,7-9,14-15,18-21,23H2/t29-,30-/s2
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80n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072334
PNG
(CHEMBL3409118)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-15-16-28-27(22-26)30(18-9-3-8-12-24-10-4-1-5-11-24)19-21-31(23-29(30)33-28)20-17-25-13-6-2-7-14-25/h1-2,4-7,10-11,13-16,22,29,32H,3,8-9,12,17-21,23H2/t29-,30-/s2
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82n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072325
PNG
(CHEMBL3409103)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-15-16-27-26(21-25)29(17-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-8-14-24-11-5-2-6-12-24/h1-6,9-12,15-16,21,28,31H,7-8,13-14,17-20,22H2/t28-,29-/s2
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88n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072347
PNG
(CHEMBL3409108)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-4-8-22(18-23)13-16-33-17-15-28(14-5-9-21-6-2-1-3-7-21)25-19-24(34)11-12-26(25)35-27(28)20-33/h1-4,6-8,10-12,18-19,27,34H,5,9,13-17,20H2/t27-,28-/s2
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93n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072327
PNG
(CHEMBL3409101)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-23-10-8-22(9-11-23)14-17-30-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(31)12-13-26(25)32-27(28)20-30/h1-3,5-6,8-13,19,27,31H,4,7,14-18,20H2/t27-,28-/s2
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110n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072328
PNG
(CHEMBL3409100)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H31NO2/c30-24-13-14-26-25(20-24)28(16-7-12-22-8-3-1-4-9-22)17-19-29(21-27(28)31-26)18-15-23-10-5-2-6-11-23/h1-6,8-11,13-14,20,27,30H,7,12,15-19,21H2/t27-,28-/s2
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110n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072347
PNG
(CHEMBL3409108)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-4-8-22(18-23)13-16-33-17-15-28(14-5-9-21-6-2-1-3-7-21)25-19-24(34)11-12-26(25)35-27(28)20-33/h1-4,6-8,10-12,18-19,27,34H,5,9,13-17,20H2/t27-,28-/s2
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116n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072346
PNG
(CHEMBL3409109)
Show SMILES [H][C@]12CN(CCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H33NO2/c31-25-14-15-27-26(21-25)29(17-8-7-13-23-9-3-1-4-10-23)18-20-30(22-28(29)32-27)19-16-24-11-5-2-6-12-24/h1-6,9-12,14-15,21,28,31H,7-8,13,16-20,22H2/t28-,29-/s2
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117n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072331
PNG
(CHEMBL3409121)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)25-12-10-24(11-13-25)16-19-35-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(36)14-15-28(27)37-29(30)22-35/h1,3-4,7-8,10-15,21,29,36H,2,5-6,9,16-20,22H2/t29-,30-/s2
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127n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072333
PNG
(CHEMBL3409119)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-25-12-10-24(11-13-25)16-19-32-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(33)14-15-28(27)34-29(30)22-32/h1,3-4,7-8,10-15,21,29,33H,2,5-6,9,16-20,22H2/t29-,30-/s2
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130n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072324
PNG
(CHEMBL3409104)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-8-22(9-11-23)14-17-33-18-16-28(15-4-7-21-5-2-1-3-6-21)25-19-24(34)12-13-26(25)35-27(28)20-33/h1-3,5-6,8-13,19,27,34H,4,7,14-18,20H2/t27-,28-/s2
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139n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072345
PNG
(CHEMBL3409110)
Show SMILES [H][C@]12CN(CCc3ccc(F)cc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-24-11-9-23(10-12-24)15-18-31-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(32)13-14-27(26)33-28(29)21-31/h1-3,6-7,9-14,20,28,32H,4-5,8,15-19,21H2/t28-,29-/s2
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147n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072335
PNG
(CHEMBL3409117)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-6-10-23(19-24)14-17-34-18-16-29(15-5-4-9-22-7-2-1-3-8-22)26-20-25(35)12-13-27(26)36-28(29)21-34/h1-3,6-8,10-13,19-20,28,35H,4-5,9,14-18,21H2/t28-,29-/s2
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148n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072329
PNG
(CHEMBL3409123)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)26-13-7-6-12-24(26)16-19-35-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)27-21-25(36)14-15-28(27)37-29(30)22-35/h1,3-4,6-7,9-10,12-15,21,29,36H,2,5,8,11,16-20,22H2/t29-,30-/s2
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159n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072326
PNG
(CHEMBL3409102)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C28H30FNO2/c29-25-11-5-4-10-22(25)14-17-30-18-16-28(15-6-9-21-7-2-1-3-8-21)24-19-23(31)12-13-26(24)32-27(28)20-30/h1-5,7-8,10-13,19,27,31H,6,9,14-18,20H2/t27-,28-/s2
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160n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072342
PNG
(CHEMBL3409113)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-9-23(10-12-24)15-18-34-19-17-29(16-5-4-8-22-6-2-1-3-7-22)26-20-25(35)13-14-27(26)36-28(29)21-34/h1-3,6-7,9-14,20,28,35H,4-5,8,15-19,21H2/t28-,29-/s2
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163n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072332
PNG
(CHEMBL3409120)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H34FNO2/c31-27-13-7-6-12-24(27)16-19-32-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)26-21-25(33)14-15-28(26)34-29(30)22-32/h1,3-4,6-7,9-10,12-15,21,29,33H,2,5,8,11,16-20,22H2/t29-,30-/s2
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177n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072321
PNG
(CHEMBL3409107)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)24-11-5-4-10-22(24)14-17-33-18-16-28(15-6-9-21-7-2-1-3-8-21)25-19-23(34)12-13-26(25)35-27(28)20-33/h1-5,7-8,10-13,19,27,34H,6,9,14-18,20H2/t27-,28-/s2
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229n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072344
PNG
(CHEMBL3409111)
Show SMILES [H][C@]12CN(CCc3ccccc3F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H32FNO2/c30-26-12-5-4-11-23(26)15-18-31-19-17-29(16-7-6-10-22-8-2-1-3-9-22)25-20-24(32)13-14-27(25)33-28(29)21-31/h1-5,8-9,11-14,20,28,32H,6-7,10,15-19,21H2/t28-,29-/s2
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230n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072340
PNG
(CHEMBL3409115)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)25-12-5-4-11-23(25)15-18-34-19-17-29(16-7-6-10-22-8-2-1-3-9-22)26-20-24(35)13-14-27(26)36-28(29)21-34/h1-5,8-9,11-14,20,28,35H,6-7,10,15-19,21H2/t28-,29-/s2
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294n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072331
PNG
(CHEMBL3409121)
Show SMILES [H][C@]12CN(CCc3ccc(cc3)C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)25-12-10-24(11-13-25)16-19-35-20-18-30(17-6-2-5-9-23-7-3-1-4-8-23)27-21-26(36)14-15-28(27)37-29(30)22-35/h1,3-4,7-8,10-15,21,29,36H,2,5-6,9,16-20,22H2/t29-,30-/s2
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297n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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299n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50072321
PNG
(CHEMBL3409107)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)24-11-5-4-10-22(24)14-17-33-18-16-28(15-6-9-21-7-2-1-3-8-21)25-19-23(34)12-13-26(25)35-27(28)20-33/h1-5,7-8,10-13,19,27,34H,6,9,14-18,20H2/t27-,28-/s2
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351n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072348
PNG
(CHEMBL3409116)
Show SMILES [H][C@]12CN(CCCCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H37NO2/c33-27-17-18-29-28(23-27)31(19-9-7-15-25-11-3-1-4-12-25)20-22-32(24-30(31)34-29)21-10-8-16-26-13-5-2-6-14-26/h1-6,11-14,17-18,23,30,33H,7-10,15-16,19-22,24H2/t30-,31-/s2
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410n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072343
PNG
(CHEMBL3409112)
Show SMILES [H][C@]12CN(CCCc3ccccc3)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H35NO2/c32-26-16-17-28-27(22-26)30(18-8-7-14-24-10-3-1-4-11-24)19-21-31(23-29(30)33-28)20-9-15-25-12-5-2-6-13-25/h1-6,10-13,16-17,22,29,32H,7-9,14-15,18-21,23H2/t29-,30-/s2
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424n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072340
PNG
(CHEMBL3409115)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)25-12-5-4-11-23(25)15-18-34-19-17-29(16-7-6-10-22-8-2-1-3-9-22)26-20-24(35)13-14-27(26)36-28(29)21-34/h1-5,8-9,11-14,20,28,35H,6-7,10,15-19,21H2/t28-,29-/s2
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589n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50000092
PNG
((-)-(etorphine) | (-)-morphine | (1S,5R,13R,14S)-1...)
Show SMILES CN1CC[C@@]23[C@H]4Oc5c2c(C[C@@H]1[C@@H]3C=C[C@@H]4O)ccc5O |r,c:16,TLB:13:12:8.9.10:3.2.1|
Show InChI InChI=1S/C17H19NO3/c1-18-7-6-17-10-3-5-13(20)16(17)21-15-12(19)4-2-9(14(15)17)8-11(10)18/h2-5,10-11,13,16,19-20H,6-8H2,1H3/t10-,11+,13-,16-,17-/m0/s1
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605n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50072329
PNG
(CHEMBL3409123)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)26-13-7-6-12-24(26)16-19-35-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)27-21-25(36)14-15-28(27)37-29(30)22-35/h1,3-4,6-7,9-10,12-15,21,29,36H,2,5,8,11,16-20,22H2/t29-,30-/s2
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719n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072321
PNG
(CHEMBL3409107)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)24-11-5-4-10-22(24)14-17-33-18-16-28(15-6-9-21-7-2-1-3-8-21)25-19-23(34)12-13-26(25)35-27(28)20-33/h1-5,7-8,10-13,19,27,34H,6,9,14-18,20H2/t27-,28-/s2
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795n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072347
PNG
(CHEMBL3409108)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C29H30F3NO2/c30-29(31,32)23-10-4-8-22(18-23)13-16-33-17-15-28(14-5-9-21-6-2-1-3-7-21)25-19-24(34)11-12-26(25)35-27(28)20-33/h1-4,6-8,10-12,18-19,27,34H,5,9,13-17,20H2/t27-,28-/s2
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923n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072329
PNG
(CHEMBL3409123)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C31H34F3NO2/c32-31(33,34)26-13-7-6-12-24(26)16-19-35-20-18-30(17-8-2-5-11-23-9-3-1-4-10-23)27-21-25(36)14-15-28(27)37-29(30)22-35/h1,3-4,6-7,9-10,12-15,21,29,36H,2,5,8,11,16-20,22H2/t29-,30-/s2
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1.12E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-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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1.50E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072340
PNG
(CHEMBL3409115)
Show SMILES [H][C@]12CN(CCc3ccccc3C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)25-12-5-4-11-23(25)15-18-34-19-17-29(16-7-6-10-22-8-2-1-3-9-22)26-20-24(35)13-14-27(26)36-28(29)21-34/h1-5,8-9,11-14,20,28,35H,6-7,10,15-19,21H2/t28-,29-/s2
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1.77E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)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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>2.00E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DAMGO from human recombinant opioid mu receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting meth...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50072335
PNG
(CHEMBL3409117)
Show SMILES [H][C@]12CN(CCc3cccc(c3)C(F)(F)F)CC[C@@]1(CCCCc1ccccc1)c1cc(O)ccc1O2 |r|
Show InChI InChI=1/C30H32F3NO2/c31-30(32,33)24-11-6-10-23(19-24)14-17-34-18-16-29(15-5-4-9-22-7-2-1-3-8-22)26-20-25(35)12-13-27(26)36-28(29)21-34/h1-3,6-8,10-13,19-20,28,35H,4-5,9,14-18,21H2/t28-,29-/s2
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3.18E+3n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]U69,593 from human recombinant opioid kappa receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50381677
PNG
(CHEMBL1256748 | U-69593)
Show SMILES CN([C@H]1C[C@@]2(CCCO2)CC[C@@H]1N1CCCC1)C(=O)Cc1ccccc1 |r|
Show InChI InChI=1S/C22H32N2O2/c1-23(21(25)16-18-8-3-2-4-9-18)20-17-22(11-7-15-26-22)12-10-19(20)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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>1.20E+4n/an/an/an/an/an/an/an/a



National Institute on Drug Abuse

Curated by ChEMBL


Assay Description
Displacement of [3H]DADLE from human recombinant opioid delta receptor expressed in CHO cell membranes after 2 hrs by liquid scintillation counting m...


Eur J Med Chem 92: 531-9 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.025
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%