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PubMed code 11052793

Compile data set for download or QSAR
Found 115 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))
BDBM50039026
PNG
(4-((R)-((2S,5R)-4-allyl-2,5-dimethylpiperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1
Show InChI InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
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n/an/a 0.230n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092669
PNG
(CHEMBL129420 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cccnc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-12-10-20(11-13-21)24(29-17-15-26-16-18-29)22-9-5-7-19-8-6-14-27-23(19)22/h5-14,24,26H,3-4,15-18H2,1-2H3
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n/an/a 0.510n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092664
PNG
(CHEMBL126819 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cccnc2c1
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-10-8-20(9-11-21)24(29-16-14-26-15-17-29)22-12-7-19-6-5-13-27-23(19)18-22/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 1.10n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092676
PNG
(4-[(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yl)-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2CC(C)(C)Oc12
Show InChI InChI=1S/C26H35N3O2/c1-5-28(6-2)25(30)20-12-10-19(11-13-20)23(29-16-14-27-15-17-29)22-9-7-8-21-18-26(3,4)31-24(21)22/h7-13,23,27H,5-6,14-18H2,1-4H3
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n/an/a 1.20n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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n/an/a 1.30n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50039026
PNG
(4-((R)-((2S,5R)-4-allyl-2,5-dimethylpiperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1
Show InChI InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
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n/an/a 2.10n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092680
PNG
(CHEMBL125734 | N,N-Diethyl-4-(naphthalen-1-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-14-12-21(13-15-22)25(29-18-16-27-17-19-29)24-11-7-9-20-8-5-6-10-23(20)24/h5-15,25,27H,3-4,16-19H2,1-2H3
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n/an/a 2.40n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092683
PNG
(CHEMBL126366 | N,N-Diethyl-4-(isoquinolin-5-yl-pip...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-10-8-19(9-11-20)24(29-16-14-26-15-17-29)23-7-5-6-21-18-27-13-12-22(21)23/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 4.10n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092665
PNG
(CHEMBL340834 | N,N-Diethyl-4-[(3-fluoro-phenyl)-pi...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(F)c1
Show InChI InChI=1S/C22H28FN3O/c1-3-25(4-2)22(27)18-10-8-17(9-11-18)21(26-14-12-24-13-15-26)19-6-5-7-20(23)16-19/h5-11,16,21,24H,3-4,12-15H2,1-2H3
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n/an/a 4.5n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50023913
PNG
(CHEMBL2112649)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cc[nH]c2c1
Show InChI InChI=1/C24H30N4O/c1-3-27(4-2)24(29)20-8-6-19(7-9-20)23(28-15-13-25-14-16-28)21-10-5-18-11-12-26-22(18)17-21/h5-12,17,23,25-26H,3-4,13-16H2,1-2H3
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n/an/a 6.80n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092673
PNG
(CHEMBL126223 | N,N-Diethyl-4-(naphthalen-2-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-12-10-21(11-13-22)25(29-17-15-27-16-18-29)24-14-9-20-7-5-6-8-23(20)19-24/h5-14,19,25,27H,3-4,15-18H2,1-2H3
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n/an/a 7.60n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092661
PNG
(CHEMBL127638 | N,N-Diethyl-4-[(4-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(OC)cc1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)20-8-6-18(7-9-20)22(26-16-14-24-15-17-26)19-10-12-21(28-3)13-11-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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n/an/a 8.10n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092688
PNG
(CHEMBL128005 | N,N-Diethyl-4-(piperazin-1-yl-p-tol...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(C)cc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-12-10-20(11-13-21)22(26-16-14-24-15-17-26)19-8-6-18(3)7-9-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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n/an/a 8.40n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092681
PNG
(CHEMBL127434 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)(C)NCC1C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-18-26(4,5)27-17-19(29)3/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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n/an/a 8.40n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092668
PNG
(CHEMBL126382 | N,N-Diethyl-4-(phenyl-piperidin-4-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCNCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
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n/an/a 8.80n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084251
PNG
(CHEMBL338980 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C22H29N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h5-13,21,23H,3-4,14-17H2,1-2H3
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n/an/a 11n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50077066
PNG
(4-[(4-Allyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC=C)CC1)c1ccccc1
Show InChI InChI=1S/C25H33N3O/c1-4-16-26-17-19-28(20-18-26)24(21-10-8-7-9-11-21)22-12-14-23(15-13-22)25(29)27(5-2)6-3/h4,7-15,24H,1,5-6,16-20H2,2-3H3
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n/an/a 16n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092684
PNG
(4-[(4-Chloro-phenyl)-piperazin-1-yl-methyl]-N,N-di...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H28ClN3O/c1-3-25(4-2)22(27)19-7-5-17(6-8-19)21(26-15-13-24-14-16-26)18-9-11-20(23)12-10-18/h5-12,21,24H,3-4,13-16H2,1-2H3
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n/an/a 19n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092675
PNG
(4-([1,4]Diazepan-1-yl-phenyl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCCNCC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-3-25(4-2)23(27)21-13-11-20(12-14-21)22(19-9-6-5-7-10-19)26-17-8-15-24-16-18-26/h5-7,9-14,22,24H,3-4,8,15-18H2,1-2H3
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n/an/a 20n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50039026
PNG
(4-((R)-((2S,5R)-4-allyl-2,5-dimethylpiperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1
Show InChI InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092671
PNG
(CHEMBL125742 | N,N-Diethyl-4-[(3-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(OC)c1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)19-11-9-18(10-12-19)22(26-15-13-24-14-16-26)20-7-6-8-21(17-20)28-3/h6-12,17,22,24H,4-5,13-16H2,1-3H3
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n/an/a 25n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092689
PNG
(4-[(4-Butyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCCCN1CCN(CC1)C(c1ccccc1)c1ccc(cc1)C(=O)N(CC)CC
Show InChI InChI=1S/C26H37N3O/c1-4-7-17-27-18-20-29(21-19-27)25(22-11-9-8-10-12-22)23-13-15-24(16-14-23)26(30)28(5-2)6-3/h8-16,25H,4-7,17-21H2,1-3H3
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n/an/a 29n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092686
PNG
(4-[(4-Cyclopropylmethyl-piperazin-1-yl)-phenyl-met...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC2CC2)CC1)c1ccccc1
Show InChI InChI=1S/C26H35N3O/c1-3-28(4-2)26(30)24-14-12-23(13-15-24)25(22-8-6-5-7-9-22)29-18-16-27(17-19-29)20-21-10-11-21/h5-9,12-15,21,25H,3-4,10-11,16-20H2,1-2H3
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n/an/a 35n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092693
PNG
(CHEMBL339621 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C21H29N3O2S/c1-3-24(4-2)27(25,26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)23-16-14-22-15-17-23/h5-13,21-22H,3-4,14-17H2,1-2H3
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n/an/a 38n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084248
PNG
(CHEMBL124642 | CHEMBL555571 | N,N-Diethyl-4-[(4-me...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(C)CC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-13-11-20(12-14-21)22(19-9-7-6-8-10-19)26-17-15-24(3)16-18-26/h6-14,22H,4-5,15-18H2,1-3H3
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n/an/a 40n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092687
PNG
(CHEMBL434817 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)NCC1(C)C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-17-19(3)27-18-26(29,4)5/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092696
PNG
(CHEMBL339034 | N,N-Dimethyl-4-(phenyl-piperazin-1-...)
Show SMILES CN(C)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C20H25N3O/c1-22(2)20(24)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)23-14-12-21-13-15-23/h3-11,19,21H,12-15H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092670
PNG
(CHEMBL338535 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2ncccc2c1
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-9-7-19(8-10-20)24(29-16-14-26-15-17-29)22-11-12-23-21(18-22)6-5-13-27-23/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 62n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092690
PNG
(CHEMBL338436 | N,N-Diethyl-4-{[methyl-(2-methylami...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N(C)CCNC)c1ccccc1
Show InChI InChI=1S/C22H31N3O/c1-5-25(6-2)22(26)20-14-12-19(13-15-20)21(24(4)17-16-23-3)18-10-8-7-9-11-18/h7-15,21,23H,5-6,16-17H2,1-4H3
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n/an/a 92n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092662
PNG
(4-(Cyclohexyl-piperazin-1-yl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCCCC1)N1CCNCC1
Show InChI InChI=1S/C22H35N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h10-13,18,21,23H,3-9,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092694
PNG
(2-Ethyl-1-[4-(phenyl-piperazin-1-yl-methyl)-phenyl...)
Show SMILES CCC(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-18(4-2)23(26)21-12-10-20(11-13-21)22(19-8-6-5-7-9-19)25-16-14-24-15-17-25/h5-13,18,22,24H,3-4,14-17H2,1-2H3
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n/an/a 100n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092692
PNG
(CHEMBL126413 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccnc2ccccc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-11-9-19(10-12-20)24(29-17-15-26-16-18-29)22-13-14-27-23-8-6-5-7-21(22)23/h5-14,24,26H,3-4,15-18H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092678
PNG
(CHEMBL125741 | N-Ethyl-4-(phenyl-piperazin-1-yl-me...)
Show SMILES CCNC(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C20H25N3O/c1-2-22-20(24)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)23-14-12-21-13-15-23/h3-11,19,21H,2,12-15H2,1H3,(H,22,24)
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092662
PNG
(4-(Cyclohexyl-piperazin-1-yl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCCCC1)N1CCNCC1
Show InChI InChI=1S/C22H35N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h10-13,18,21,23H,3-9,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092674
PNG
(1-{Phenyl-[4-(1H-tetrazol-5-yl)-phenyl]-methyl}-pi...)
Show SMILES C1CN(CCN1)C(c1ccccc1)c1ccc(cc1)-c1nnn[nH]1
Show InChI InChI=1S/C18H20N6/c1-2-4-14(5-3-1)17(24-12-10-19-11-13-24)15-6-8-16(9-7-15)18-20-22-23-21-18/h1-9,17,19H,10-13H2,(H,20,21,22,23)
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092687
PNG
(CHEMBL434817 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)NCC1(C)C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-17-19(3)27-18-26(29,4)5/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092697
PNG
(4-(Phenyl-piperazin-1-yl-methyl)-benzoic acid meth...)
Show SMILES COC(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H22N2O2/c1-23-19(22)17-9-7-16(8-10-17)18(15-5-3-2-4-6-15)21-13-11-20-12-14-21/h2-10,18,20H,11-14H2,1H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092677
PNG
(2-[4-(Phenyl-piperazin-1-yl-methyl)-phenyl]-propan...)
Show SMILES CC(C)(O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C20H26N2O/c1-20(2,23)18-10-8-17(9-11-18)19(16-6-4-3-5-7-16)22-14-12-21-13-15-22/h3-11,19,21,23H,12-15H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092672
PNG
(4-(Phenyl-piperazin-1-yl-methyl)-benzoic acid | CH...)
Show SMILES OC(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C18H20N2O2/c21-18(22)16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)20-12-10-19-11-13-20/h1-9,17,19H,10-13H2,(H,21,22)
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092689
PNG
(4-[(4-Butyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCCCN1CCN(CC1)C(c1ccccc1)c1ccc(cc1)C(=O)N(CC)CC
Show InChI InChI=1S/C26H37N3O/c1-4-7-17-27-18-20-29(21-19-27)25(22-11-9-8-10-12-22)23-13-15-24(16-14-23)26(30)28(5-2)6-3/h8-16,25H,4-7,17-21H2,1-3H3
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n/an/a 486n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092666
PNG
(4-(Phenyl-piperazin-1-yl-methyl)-benzamide | CHEMB...)
Show SMILES NC(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C18H21N3O/c19-18(22)16-8-6-15(7-9-16)17(14-4-2-1-3-5-14)21-12-10-20-11-13-21/h1-9,17,20H,10-13H2,(H2,19,22)
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n/an/a 509n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092682
PNG
(CHEMBL127346 | Diethyl-[4-(phenyl-piperazin-1-yl-m...)
Show SMILES CCN(CC)Cc1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C22H31N3/c1-3-24(4-2)18-19-10-12-21(13-11-19)22(20-8-6-5-7-9-20)25-16-14-23-15-17-25/h5-13,22-23H,3-4,14-18H2,1-2H3
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n/an/a 555n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092681
PNG
(CHEMBL127434 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)(C)NCC1C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-18-26(4,5)27-17-19(29)3/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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n/an/a 620n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092669
PNG
(CHEMBL129420 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cccnc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-12-10-20(11-13-21)24(29-17-15-26-16-18-29)22-9-5-7-19-8-6-14-27-23(19)22/h5-14,24,26H,3-4,15-18H2,1-2H3
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n/an/a 632n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092662
PNG
(4-(Cyclohexyl-piperazin-1-yl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCCCC1)N1CCNCC1
Show InChI InChI=1S/C22H35N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h10-13,18,21,23H,3-9,14-17H2,1-2H3
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n/an/a 724n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092680
PNG
(CHEMBL125734 | N,N-Diethyl-4-(naphthalen-1-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-14-12-21(13-15-22)25(29-18-16-27-17-19-29)24-11-7-9-20-8-5-6-10-23(20)24/h5-15,25,27H,3-4,16-19H2,1-2H3
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n/an/a 777n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092676
PNG
(4-[(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yl)-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2CC(C)(C)Oc12
Show InChI InChI=1S/C26H35N3O2/c1-5-28(6-2)25(30)20-12-10-19(11-13-20)23(29-16-14-27-15-17-29)22-9-7-8-21-18-26(3,4)31-24(21)22/h7-13,23,27H,5-6,14-18H2,1-4H3
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n/an/a 785n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092664
PNG
(CHEMBL126819 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cccnc2c1
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-10-8-20(9-11-21)24(29-16-14-26-15-17-29)22-12-7-19-6-5-13-27-23(19)18-22/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 1.02E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092691
PNG
(1-[4-(Phenyl-piperazin-1-yl-methyl)-phenyl]-ethano...)
Show SMILES CC(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C19H22N2O/c1-15(22)16-7-9-18(10-8-16)19(17-5-3-2-4-6-17)21-13-11-20-12-14-21/h2-10,19-20H,11-14H2,1H3
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n/an/a 1.05E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092695
PNG
(4-(Phenyl-piperazin-1-yl-methyl)-benzonitrile | CH...)
Show SMILES N#Cc1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C18H19N3/c19-14-15-6-8-17(9-7-15)18(16-4-2-1-3-5-16)21-12-10-20-11-13-21/h1-9,18,20H,10-13H2
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n/an/a 1.29E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092683
PNG
(CHEMBL126366 | N,N-Diethyl-4-(isoquinolin-5-yl-pip...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-10-8-19(9-11-20)24(29-16-14-26-15-17-29)23-7-5-6-21-18-27-13-12-22(21)23/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 1.48E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092685
PNG
(2-Methyl-6-[4-(phenyl-piperazin-1-yl-methyl)-pheny...)
Show SMILES CN1CCc2cc(ccc2C1=O)-c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C27H29N3O/c1-29-16-13-24-19-23(11-12-25(24)27(29)31)20-7-9-22(10-8-20)26(21-5-3-2-4-6-21)30-17-14-28-15-18-30/h2-12,19,26,28H,13-18H2,1H3
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n/an/a 1.65E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092663
PNG
(4-[(4-Acetyl-piperazin-1-yl)-phenyl-methyl]-N,N-di...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC1)C(C)=O)c1ccccc1
Show InChI InChI=1S/C24H31N3O2/c1-4-25(5-2)24(29)22-13-11-21(12-14-22)23(20-9-7-6-8-10-20)27-17-15-26(16-18-27)19(3)28/h6-14,23H,4-5,15-18H2,1-3H3
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n/an/a>2.00E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50023913
PNG
(CHEMBL2112649)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cc[nH]c2c1
Show InChI InChI=1/C24H30N4O/c1-3-27(4-2)24(29)20-8-6-19(7-9-20)23(28-15-13-25-14-16-28)21-10-5-18-11-12-26-22(18)17-21/h5-12,17,23,25-26H,3-4,13-16H2,1-2H3
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n/an/a 2.22E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084249
PNG
(CHEMBL127240 | N,N-Diethyl-4-(phenyl-piperidin-1-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCCCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-24(4-2)23(26)21-15-13-20(14-16-21)22(19-11-7-5-8-12-19)25-17-9-6-10-18-25/h5,7-8,11-16,22H,3-4,6,9-10,17-18H2,1-2H3
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n/an/a 2.23E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092675
PNG
(4-([1,4]Diazepan-1-yl-phenyl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCCNCC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-3-25(4-2)23(27)21-13-11-20(12-14-21)22(19-9-6-5-7-10-19)26-17-8-15-24-16-18-26/h5-7,9-14,22,24H,3-4,8,15-18H2,1-2H3
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n/an/a 2.29E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092686
PNG
(4-[(4-Cyclopropylmethyl-piperazin-1-yl)-phenyl-met...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC2CC2)CC1)c1ccccc1
Show InChI InChI=1S/C26H35N3O/c1-3-28(4-2)26(30)24-14-12-23(13-15-24)25(22-8-6-5-7-9-22)29-18-16-27(17-19-29)20-21-10-11-21/h5-9,12-15,21,25H,3-4,10-11,16-20H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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n/an/a 2.48E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092673
PNG
(CHEMBL126223 | N,N-Diethyl-4-(naphthalen-2-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-12-10-21(11-13-22)25(29-17-15-27-16-18-29)24-14-9-20-7-5-6-8-23(20)19-24/h5-14,19,25,27H,3-4,15-18H2,1-2H3
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n/an/a 2.68E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092664
PNG
(CHEMBL126819 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cccnc2c1
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-10-8-20(9-11-21)24(29-16-14-26-15-17-29)22-12-7-19-6-5-13-27-23(19)18-22/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50023913
PNG
(CHEMBL2112649)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cc[nH]c2c1
Show InChI InChI=1/C24H30N4O/c1-3-27(4-2)24(29)20-8-6-19(7-9-20)23(28-15-13-25-14-16-28)21-10-5-18-11-12-26-22(18)17-21/h5-12,17,23,25-26H,3-4,13-16H2,1-2H3
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n/an/a 3.97E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092675
PNG
(4-([1,4]Diazepan-1-yl-phenyl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCCNCC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-3-25(4-2)23(27)21-13-11-20(12-14-21)22(19-9-6-5-7-10-19)26-17-8-15-24-16-18-26/h5-7,9-14,22,24H,3-4,8,15-18H2,1-2H3
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n/an/a 4.53E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092661
PNG
(CHEMBL127638 | N,N-Diethyl-4-[(4-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(OC)cc1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)20-8-6-18(7-9-20)22(26-16-14-24-15-17-26)19-10-12-21(28-3)13-11-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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n/an/a 4.54E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092680
PNG
(CHEMBL125734 | N,N-Diethyl-4-(naphthalen-1-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-14-12-21(13-15-22)25(29-18-16-27-17-19-29)24-11-7-9-20-8-5-6-10-23(20)24/h5-15,25,27H,3-4,16-19H2,1-2H3
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n/an/a 4.91E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50077066
PNG
(4-[(4-Allyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC=C)CC1)c1ccccc1
Show InChI InChI=1S/C25H33N3O/c1-4-16-26-17-19-28(20-18-26)24(21-10-8-7-9-11-21)22-12-14-23(15-13-22)25(29)27(5-2)6-3/h4,7-15,24H,1,5-6,16-20H2,2-3H3
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n/an/a 5.06E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092671
PNG
(CHEMBL125742 | N,N-Diethyl-4-[(3-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(OC)c1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)19-11-9-18(10-12-19)22(26-15-13-24-14-16-26)20-7-6-8-21(17-20)28-3/h6-12,17,22,24H,4-5,13-16H2,1-3H3
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n/an/a 5.29E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092684
PNG
(4-[(4-Chloro-phenyl)-piperazin-1-yl-methyl]-N,N-di...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H28ClN3O/c1-3-25(4-2)22(27)19-7-5-17(6-8-19)21(26-15-13-24-14-16-26)18-9-11-20(23)12-10-18/h5-12,21,24H,3-4,13-16H2,1-2H3
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n/an/a 5.33E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092686
PNG
(4-[(4-Cyclopropylmethyl-piperazin-1-yl)-phenyl-met...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC2CC2)CC1)c1ccccc1
Show InChI InChI=1S/C26H35N3O/c1-3-28(4-2)26(30)24-14-12-23(13-15-24)25(22-8-6-5-7-9-22)29-18-16-27(17-19-29)20-21-10-11-21/h5-9,12-15,21,25H,3-4,10-11,16-20H2,1-2H3
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n/an/a>5.60E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092665
PNG
(CHEMBL340834 | N,N-Diethyl-4-[(3-fluoro-phenyl)-pi...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(F)c1
Show InChI InChI=1S/C22H28FN3O/c1-3-25(4-2)22(27)18-10-8-17(9-11-18)21(26-14-12-24-13-15-26)19-6-5-7-20(23)16-19/h5-11,16,21,24H,3-4,12-15H2,1-2H3
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n/an/a 5.65E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092690
PNG
(CHEMBL338436 | N,N-Diethyl-4-{[methyl-(2-methylami...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N(C)CCNC)c1ccccc1
Show InChI InChI=1S/C22H31N3O/c1-5-25(6-2)22(26)20-14-12-19(13-15-20)21(24(4)17-16-23-3)18-10-8-7-9-11-18/h7-15,21,23H,5-6,16-17H2,1-4H3
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n/an/a 6.97E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50084248
PNG
(CHEMBL124642 | CHEMBL555571 | N,N-Diethyl-4-[(4-me...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(C)CC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-13-11-20(12-14-21)22(19-9-7-6-8-10-19)26-17-15-24(3)16-18-26/h6-14,22H,4-5,15-18H2,1-3H3
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n/an/a 6.97E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092669
PNG
(CHEMBL129420 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cccnc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-12-10-20(11-13-21)24(29-17-15-26-16-18-29)22-9-5-7-19-8-6-14-27-23(19)22/h5-14,24,26H,3-4,15-18H2,1-2H3
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n/an/a 7.02E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092688
PNG
(CHEMBL128005 | N,N-Diethyl-4-(piperazin-1-yl-p-tol...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(C)cc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-12-10-20(11-13-21)22(26-16-14-24-15-17-26)19-8-6-18(3)7-9-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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n/an/a 7.09E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50077066
PNG
(4-[(4-Allyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC=C)CC1)c1ccccc1
Show InChI InChI=1S/C25H33N3O/c1-4-16-26-17-19-28(20-18-26)24(21-10-8-7-9-11-21)22-12-14-23(15-13-22)25(29)27(5-2)6-3/h4,7-15,24H,1,5-6,16-20H2,2-3H3
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n/an/a 7.57E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092676
PNG
(4-[(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yl)-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2CC(C)(C)Oc12
Show InChI InChI=1S/C26H35N3O2/c1-5-28(6-2)25(30)20-12-10-19(11-13-20)23(29-16-14-27-15-17-29)22-9-7-8-21-18-26(3,4)31-24(21)22/h7-13,23,27H,5-6,14-18H2,1-4H3
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n/an/a>7.60E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50084251
PNG
(CHEMBL338980 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C22H29N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h5-13,21,23H,3-4,14-17H2,1-2H3
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n/an/a 8.15E+3n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092681
PNG
(CHEMBL127434 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)(C)NCC1C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-18-26(4,5)27-17-19(29)3/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50084248
PNG
(CHEMBL124642 | CHEMBL555571 | N,N-Diethyl-4-[(4-me...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(C)CC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-13-11-20(12-14-21)22(19-9-7-6-8-10-19)26-17-15-24(3)16-18-26/h6-14,22H,4-5,15-18H2,1-3H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092684
PNG
(4-[(4-Chloro-phenyl)-piperazin-1-yl-methyl]-N,N-di...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H28ClN3O/c1-3-25(4-2)22(27)19-7-5-17(6-8-19)21(26-15-13-24-14-16-26)18-9-11-20(23)12-10-18/h5-12,21,24H,3-4,13-16H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084239
PNG
(CHEMBL125626 | N,N-Diethyl-4-(morpholin-4-yl-pheny...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C22H28N2O2/c1-3-23(4-2)22(25)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)24-14-16-26-17-15-24/h5-13,21H,3-4,14-17H2,1-2H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against human opioid receptor delta 1 using [125I]-[D-Ala2]-deltorphin II as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092661
PNG
(CHEMBL127638 | N,N-Diethyl-4-[(4-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(OC)cc1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)20-8-6-18(7-9-20)22(26-16-14-24-15-17-26)19-10-12-21(28-3)13-11-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50092668
PNG
(CHEMBL126382 | N,N-Diethyl-4-(phenyl-piperidin-4-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCNCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor mu 1 using [125I]FK33824 as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092687
PNG
(CHEMBL434817 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)NCC1(C)C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-17-19(3)27-18-26(29,4)5/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092690
PNG
(CHEMBL338436 | N,N-Diethyl-4-{[methyl-(2-methylami...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N(C)CCNC)c1ccccc1
Show InChI InChI=1S/C22H31N3O/c1-5-25(6-2)22(26)20-14-12-19(13-15-20)21(24(4)17-16-23-3)18-10-8-7-9-11-18/h7-15,21,23H,5-6,16-17H2,1-4H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092683
PNG
(CHEMBL126366 | N,N-Diethyl-4-(isoquinolin-5-yl-pip...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-10-8-19(9-11-20)24(29-16-14-26-15-17-29)23-7-5-6-21-18-27-13-12-22(21)23/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092668
PNG
(CHEMBL126382 | N,N-Diethyl-4-(phenyl-piperidin-4-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCNCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50084251
PNG
(CHEMBL338980 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C22H29N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h5-13,21,23H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092665
PNG
(CHEMBL340834 | N,N-Diethyl-4-[(3-fluoro-phenyl)-pi...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(F)c1
Show InChI InChI=1S/C22H28FN3O/c1-3-25(4-2)22(27)18-10-8-17(9-11-18)21(26-14-12-24-13-15-26)19-6-5-7-20(23)16-19/h5-11,16,21,24H,3-4,12-15H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092688
PNG
(CHEMBL128005 | N,N-Diethyl-4-(piperazin-1-yl-p-tol...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(C)cc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-12-10-20(11-13-21)22(26-16-14-24-15-17-26)19-8-6-18(3)7-9-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092689
PNG
(4-[(4-Butyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCCCN1CCN(CC1)C(c1ccccc1)c1ccc(cc1)C(=O)N(CC)CC
Show InChI InChI=1S/C26H37N3O/c1-4-7-17-27-18-20-29(21-19-27)25(22-11-9-8-10-12-22)23-13-15-24(16-14-23)26(30)28(5-2)6-3/h8-16,25H,4-7,17-21H2,1-3H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092671
PNG
(CHEMBL125742 | N,N-Diethyl-4-[(3-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(OC)c1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)19-11-9-18(10-12-19)22(26-15-13-24-14-16-26)20-7-6-8-21(17-20)28-3/h6-12,17,22,24H,4-5,13-16H2,1-3H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM50092673
PNG
(CHEMBL126223 | N,N-Diethyl-4-(naphthalen-2-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-12-10-21(11-13-22)25(29-17-15-27-16-18-29)24-14-9-20-7-5-6-8-23(20)19-24/h5-14,19,25,27H,3-4,15-18H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Binding affinity against cloned human Opioid receptor kappa 1 using [125I]-D-Pro10-dynorphin A[1-11] as radioligand


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092664
PNG
(CHEMBL126819 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cccnc2c1
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-10-8-20(9-11-21)24(29-16-14-26-15-17-29)22-12-7-19-6-5-13-27-23(19)18-22/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092680
PNG
(CHEMBL125734 | N,N-Diethyl-4-(naphthalen-1-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2ccccc12
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-14-12-21(13-15-22)25(29-18-16-27-17-19-29)24-11-7-9-20-8-5-6-10-23(20)24/h5-15,25,27H,3-4,16-19H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092661
PNG
(CHEMBL127638 | N,N-Diethyl-4-[(4-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(OC)cc1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)20-8-6-18(7-9-20)22(26-16-14-24-15-17-26)19-10-12-21(28-3)13-11-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092683
PNG
(CHEMBL126366 | N,N-Diethyl-4-(isoquinolin-5-yl-pip...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cnccc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)20-10-8-19(9-11-20)24(29-16-14-26-15-17-29)23-7-5-6-21-18-27-13-12-22(21)23/h5-13,18,24,26H,3-4,14-17H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092687
PNG
(CHEMBL434817 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)NCC1(C)C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-17-19(3)27-18-26(29,4)5/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50023913
PNG
(CHEMBL2112649)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2cc[nH]c2c1
Show InChI InChI=1/C24H30N4O/c1-3-27(4-2)24(29)20-8-6-19(7-9-20)23(28-15-13-25-14-16-28)21-10-5-18-11-12-26-22(18)17-21/h5-12,17,23,25-26H,3-4,13-16H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092684
PNG
(4-[(4-Chloro-phenyl)-piperazin-1-yl-methyl]-N,N-di...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(Cl)cc1
Show InChI InChI=1S/C22H28ClN3O/c1-3-25(4-2)22(27)19-7-5-17(6-8-19)21(26-15-13-24-14-16-26)18-9-11-20(23)12-10-18/h5-12,21,24H,3-4,13-16H2,1-2H3
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AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092671
PNG
(CHEMBL125742 | N,N-Diethyl-4-[(3-methoxy-phenyl)-p...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(OC)c1
Show InChI InChI=1S/C23H31N3O2/c1-4-25(5-2)23(27)19-11-9-18(10-12-19)22(26-15-13-24-14-16-26)20-7-6-8-21(17-20)28-3/h6-12,17,22,24H,4-5,13-16H2,1-3H3
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n/an/an/an/a 42n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50039029
PNG
((+)-4-((alpha R)-((2S,5R)-4-allyl-2,5-dimethylpipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(OC)c1 |r|
Show InChI InChI=1S/C28H39N3O2/c1-7-17-30-19-22(5)31(20-21(30)4)27(25-11-10-12-26(18-25)33-6)23-13-15-24(16-14-23)28(32)29(8-2)9-3/h7,10-16,18,21-22,27H,1,8-9,17,19-20H2,2-6H3/t21-,22+,27-/m1/s1
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n/an/an/an/a 3.70n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084251
PNG
(CHEMBL338980 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C22H29N3O/c1-3-24(4-2)22(26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)25-16-14-23-15-17-25/h5-13,21,23H,3-4,14-17H2,1-2H3
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n/an/an/an/a 37n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092681
PNG
(CHEMBL127434 | N,N-Diethyl-4-[(3-methoxy-phenyl)-(...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CC(C)(C)NCC1C)c1cccc(OC)c1
Show InChI InChI=1S/C26H37N3O2/c1-7-28(8-2)25(30)21-14-12-20(13-15-21)24(22-10-9-11-23(16-22)31-6)29-18-26(4,5)27-17-19(29)3/h9-16,19,24,27H,7-8,17-18H2,1-6H3
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n/an/an/an/a 10n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092673
PNG
(CHEMBL126223 | N,N-Diethyl-4-(naphthalen-2-yl-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc2ccccc2c1
Show InChI InChI=1S/C26H31N3O/c1-3-28(4-2)26(30)22-12-10-21(11-13-22)25(29-17-15-27-16-18-29)24-14-9-20-7-5-6-8-23(20)19-24/h5-14,19,25,27H,3-4,15-18H2,1-2H3
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n/an/an/an/a 50n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092669
PNG
(CHEMBL129420 | N,N-Diethyl-4-(piperazin-1-yl-quino...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2cccnc12
Show InChI InChI=1S/C25H30N4O/c1-3-28(4-2)25(30)21-12-10-20(11-13-21)24(29-17-15-26-16-18-29)22-9-5-7-19-8-6-14-27-23(19)22/h5-14,24,26H,3-4,15-18H2,1-2H3
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n/an/an/an/a 3.60n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092676
PNG
(4-[(2,2-Dimethyl-2,3-dihydro-benzofuran-7-yl)-pipe...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc2CC(C)(C)Oc12
Show InChI InChI=1S/C26H35N3O2/c1-5-28(6-2)25(30)20-12-10-19(11-13-20)23(29-16-14-27-15-17-29)22-9-7-8-21-18-26(3,4)31-24(21)22/h7-13,23,27H,5-6,14-18H2,1-4H3
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n/an/an/an/a 7.10n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092665
PNG
(CHEMBL340834 | N,N-Diethyl-4-[(3-fluoro-phenyl)-pi...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1cccc(F)c1
Show InChI InChI=1S/C22H28FN3O/c1-3-25(4-2)22(27)18-10-8-17(9-11-18)21(26-14-12-24-13-15-26)19-6-5-7-20(23)16-19/h5-11,16,21,24H,3-4,12-15H2,1-2H3
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n/an/an/an/a 53n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092675
PNG
(4-([1,4]Diazepan-1-yl-phenyl-methyl)-N,N-diethyl-b...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCCNCC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-3-25(4-2)23(27)21-13-11-20(12-14-21)22(19-9-6-5-7-10-19)26-17-8-15-24-16-18-26/h5-7,9-14,22,24H,3-4,8,15-18H2,1-2H3
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n/an/an/an/a 303n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092668
PNG
(CHEMBL126382 | N,N-Diethyl-4-(phenyl-piperidin-4-y...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(C1CCNCC1)c1ccccc1
Show InChI InChI=1S/C23H30N2O/c1-3-25(4-2)23(26)21-12-10-19(11-13-21)22(18-8-6-5-7-9-18)20-14-16-24-17-15-20/h5-13,20,22,24H,3-4,14-17H2,1-2H3
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n/an/an/an/a 121n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50039026
PNG
(4-((R)-((2S,5R)-4-allyl-2,5-dimethylpiperazin-1-yl...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)[C@@H](N1C[C@@H](C)N(CC=C)C[C@@H]1C)c1cccc(O)c1
Show InChI InChI=1S/C27H37N3O2/c1-6-16-29-18-21(5)30(19-20(29)4)26(24-10-9-11-25(31)17-24)22-12-14-23(15-13-22)27(32)28(7-2)8-3/h6,9-15,17,20-21,26,31H,1,7-8,16,18-19H2,2-5H3/t20-,21+,26-/m1/s1
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n/an/an/an/a 0.120n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50077066
PNG
(4-[(4-Allyl-piperazin-1-yl)-phenyl-methyl]-N,N-die...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(CC=C)CC1)c1ccccc1
Show InChI InChI=1S/C25H33N3O/c1-4-16-26-17-19-28(20-18-26)24(21-10-8-7-9-11-21)22-12-14-23(15-13-22)25(29)27(5-2)6-3/h4,7-15,24H,1,5-6,16-20H2,2-3H3
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n/an/an/an/a 33n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092693
PNG
(CHEMBL339621 | N,N-Diethyl-4-(phenyl-piperazin-1-y...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc(cc1)C(N1CCNCC1)c1ccccc1
Show InChI InChI=1S/C21H29N3O2S/c1-3-24(4-2)27(25,26)20-12-10-19(11-13-20)21(18-8-6-5-7-9-18)23-16-14-22-15-17-23/h5-13,21-22H,3-4,14-17H2,1-2H3
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n/an/an/an/a 635n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50092688
PNG
(CHEMBL128005 | N,N-Diethyl-4-(piperazin-1-yl-p-tol...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCNCC1)c1ccc(C)cc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-12-10-20(11-13-21)22(26-16-14-24-15-17-26)19-8-6-18(3)7-9-19/h6-13,22,24H,4-5,14-17H2,1-3H3
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n/an/an/an/a 78n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50084248
PNG
(CHEMBL124642 | CHEMBL555571 | N,N-Diethyl-4-[(4-me...)
Show SMILES CCN(CC)C(=O)c1ccc(cc1)C(N1CCN(C)CC1)c1ccccc1
Show InChI InChI=1S/C23H31N3O/c1-4-25(5-2)23(27)21-13-11-20(12-14-21)22(19-9-7-6-8-10-19)26-17-15-24(3)16-18-26/h6-14,22H,4-5,15-18H2,1-3H3
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n/an/an/an/a 211n/an/an/an/a



AstraZeneca R&D Montreal

Curated by ChEMBL


Assay Description
Agonist potency was measured using GTP gamma-[35S] binding assay


J Med Chem 43: 3878-94 (2000)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%