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PubMed code 10956208

Compile data set for download or QSAR
Found 121 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
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H | US1149237...)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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5n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091002
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:38:37:47.41.40:32.34.33|
Show InChI InChI=1S/C44H66N6O4/c1-6-7-17-39(45)46-21-13-8-9-14-22-47-41(53)37(24-30(2)3)49-40(52)28-48-42(54)44(33-15-11-10-12-16-33)27-34(44)29-50-23-20-43(5)31(4)38(50)25-32-18-19-35(51)26-36(32)43/h10-12,15-16,18-19,26,30-31,34,37-38,51H,6-9,13-14,17,20-25,27-29H2,1-5H3,(H2,45,46)(H,47,53)(H,48,54)(H,49,52)/t31?,34?,37?,38?,43-,44+/m1/s1
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5.30n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090990
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-7-16-38(44)45-20-12-9-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-14-10-8-11-15-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h8,10-11,14-15,17-18,25,29-30,33,36-37,50H,6-7,9,12-13,16,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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6.70n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091014
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-7-15-37(43)44-19-11-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-13-9-8-10-14-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h8-10,13-14,16-17,24,28-29,32,35-36,49H,6-7,11-12,15,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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10n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091006
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-14-38(44)45-20-12-7-8-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-15-10-9-11-16-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h9-11,15-18,25,29-30,33,36-37,50H,6-8,12-14,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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15n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091011
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-7-14-36(42)43-18-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-12-9-8-10-13-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h8-10,12-13,15-16,23,27-28,31,34-35,48H,6-7,11,14,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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18n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090991
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C40H59N7O4/c1-26(2)20-33(36(50)43-17-10-5-6-11-18-44-38(41)42)46-35(49)24-45-37(51)40(29-12-8-7-9-13-29)23-30(40)25-47-19-16-39(4)27(3)34(47)21-28-14-15-31(48)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,48H,5-6,10-11,16-21,23-25H2,1-4H3,(H,43,50)(H,45,51)(H,46,49)(H4,41,42,44)/t27?,30?,33?,34?,39-,40+/m1/s1
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36n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091018
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-37(43)44-19-12-7-8-13-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-10-9-11-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h9-11,14-17,24,28-29,32,35-36,49H,6-8,12-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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47n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090987
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N7O4/c1-25(2)19-32(35(49)42-16-9-6-10-17-43-37(40)41)45-34(48)23-44-36(50)39(28-11-7-5-8-12-28)22-29(39)24-46-18-15-38(4)26(3)33(46)20-27-13-14-30(47)21-31(27)38/h5,7-8,11-14,21,25-26,29,32-33,47H,6,9-10,15-20,22-24H2,1-4H3,(H,42,49)(H,44,50)(H,45,48)(H4,40,41,43)/t26?,29?,32?,33?,38-,39+/m1/s1
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48n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091001
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:37:38:43:53.47.46,THB:52:53:43:38.40.39|
Show InChI InChI=1S/C46H69N11O7/c1-6-27(2)38(41(62)64-5)56-40(61)35(15-11-20-52-44(49)50)55-39(60)34(14-10-19-51-43(47)48)54-37(59)25-53-42(63)46(30-12-8-7-9-13-30)24-31(46)26-57-21-18-45(4)28(3)36(57)22-29-16-17-32(58)23-33(29)45/h7-9,12-13,16-17,23,27-28,31,34-36,38,58H,6,10-11,14-15,18-22,24-26H2,1-5H3,(H,53,63)(H,54,59)(H,55,60)(H,56,61)(H4,47,48,51)(H4,49,50,52)/t27-,28?,31?,34-,35-,36?,38-,45+,46-/m0/s1
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54n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090994
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-13-37(43)44-19-11-8-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-9-7-10-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h7,9-10,14-17,24,28-29,32,35-36,49H,6,8,11-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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65n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091016
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N7O4/c1-24(2)18-31(34(48)41-15-8-9-16-42-36(39)40)44-33(47)22-43-35(49)38(27-10-6-5-7-11-27)21-28(38)23-45-17-14-37(4)25(3)32(45)19-26-12-13-29(46)20-30(26)37/h5-7,10-13,20,24-25,28,31-32,46H,8-9,14-19,21-23H2,1-4H3,(H,41,48)(H,43,49)(H,44,47)(H4,39,40,42)/t25?,28?,31?,32?,37-,38+/m1/s1
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67n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091004
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-12-36(42)43-18-10-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-8-7-9-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7-9,13-16,23,27-28,31,34-35,48H,6,10-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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68n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090988
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-36(42)43-18-11-8-12-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-9-7-10-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7,9-10,13-16,23,27-28,31,34-35,48H,6,8,11-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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68n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090996
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N7O4/c1-23(2)17-30(33(47)40-14-8-15-41-35(38)39)43-32(46)21-42-34(48)37(26-9-6-5-7-10-26)20-27(37)22-44-16-13-36(4)24(3)31(44)18-25-11-12-28(45)19-29(25)36/h5-7,9-12,19,23-24,27,30-31,45H,8,13-18,20-22H2,1-4H3,(H,40,47)(H,42,48)(H,43,46)(H4,38,39,41)/t24?,27?,30?,31?,36-,37+/m1/s1
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73n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091009
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:33:34:39:49.43.42,THB:48:49:39:34.36.35|
Show InChI InChI=1S/C44H66N10O6/c1-6-26(2)36(39(58)60-5)53-38(57)33(14-10-19-49-41(45)46)51-37(56)34(15-11-20-50-42(47)48)52-40(59)44(29-12-8-7-9-13-29)24-30(44)25-54-21-18-43(4)27(3)35(54)22-28-16-17-31(55)23-32(28)43/h7-9,12-13,16-17,23,26-27,30,33-36,55H,6,10-11,14-15,18-22,24-25H2,1-5H3,(H,51,56)(H,52,59)(H,53,57)(H4,45,46,49)(H4,47,48,50)/t26-,27?,30+,33-,34-,35?,36-,43+,44-/m0/s1
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78n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091028
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N5O4/c1-26(2)20-33(36(47)41-18-11-6-5-10-17-40)43-35(46)24-42-37(48)39(29-12-8-7-9-13-29)23-30(39)25-44-19-16-38(4)27(3)34(44)21-28-14-15-31(45)22-32(28)38/h7-9,12-15,22,26-27,30,33-34,45H,5-6,10-11,16-21,23-25,40H2,1-4H3,(H,41,47)(H,42,48)(H,43,46)/t27?,30?,33?,34?,38-,39+/m1/s1
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80n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091017
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-11-35(41)42-17-10-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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81n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090993
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C42H63N5O3/c1-6-7-17-38(43)44-21-13-8-9-14-22-45-39(49)36(24-29(2)3)46-40(50)42(32-15-11-10-12-16-32)27-33(42)28-47-23-20-41(5)30(4)37(47)25-31-18-19-34(48)26-35(31)41/h10-12,15-16,18-19,26,29-30,33,36-37,48H,6-9,13-14,17,20-25,27-28H2,1-5H3,(H2,43,44)(H,45,49)(H,46,50)/t30?,33?,36?,37?,41-,42+/m1/s1
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81n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091015
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-7-16-37(42)43-20-12-9-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-14-10-8-11-15-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h8,10-11,14-15,17-18,25,28-29,32,35-36,47H,6-7,9,12-13,16,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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98n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090995
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-7-15-36(41)42-19-11-12-20-43-37(47)34(22-27(2)3)44-38(48)40(30-13-9-8-10-14-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h8-10,13-14,16-17,24,27-28,31,34-35,46H,6-7,11-12,15,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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116n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091021
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-36(41)42-19-12-7-8-13-20-43-37(47)34(22-27(2)3)44-38(48)40(30-14-10-9-11-15-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h9-11,14-17,24,27-28,31,34-35,46H,6-8,12-13,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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117n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091000
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-14-37(42)43-20-12-7-8-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-15-10-9-11-16-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h9-11,15-18,25,28-29,32,35-36,47H,6-8,12-14,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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122n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50027808
PNG
((Dynorphin)2-[2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydro...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C46H72N14O10/c1-5-27(4)38(44(69)70)60-41(66)33(14-10-20-53-46(50)51)57-40(65)32(13-9-19-52-45(48)49)58-42(67)34(21-26(2)3)59-43(68)35(23-28-11-7-6-8-12-28)56-37(63)25-54-36(62)24-55-39(64)31(47)22-29-15-17-30(61)18-16-29/h6-8,11-12,15-18,26-27,31-35,38,61H,5,9-10,13-14,19-25,47H2,1-4H3,(H,54,62)(H,55,64)(H,56,63)(H,57,65)(H,58,67)(H,59,68)(H,60,66)(H,69,70)(H4,48,49,52)(H4,50,51,53)/t27-,31+,32+,33+,34+,35+,38+/m1/s1
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124n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091008
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C38H56N6O3/c1-25(2)20-32(34(46)41-17-10-5-6-11-18-42-36(39)40)43-35(47)38(28-12-8-7-9-13-28)23-29(38)24-44-19-16-37(4)26(3)33(44)21-27-14-15-30(45)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,45H,5-6,10-11,16-21,23-24H2,1-4H3,(H,41,46)(H,43,47)(H4,39,40,42)/t26?,29?,32?,33?,37-,38+/m1/s1
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139n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091005
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-7-14-35(40)41-18-11-19-42-36(46)33(21-26(2)3)43-37(47)39(29-12-9-8-10-13-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h8-10,12-13,15-16,23,26-27,30,33-34,45H,6-7,11,14,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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139n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091012
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-35(40)41-18-11-8-12-19-42-36(46)33(21-26(2)3)43-37(47)39(29-13-9-7-10-14-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h7,9-10,13-16,23,26-27,30,33-34,45H,6,8,11-12,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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149n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090997
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-13-36(41)42-19-11-8-12-20-43-37(47)34(22-27(2)3)44-38(48)40(30-14-9-7-10-15-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h7,9-10,14-17,24,27-28,31,34-35,46H,6,8,11-13,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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156n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091029
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-35(41)42-17-10-11-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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176n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091027
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:30:29:39.33.32:24.26.25|
Show InChI InChI=1S/C38H55N5O3/c1-6-34(39)40-17-10-11-18-41-35(45)32(20-25(2)3)42-36(46)38(28-12-8-7-9-13-28)23-29(38)24-43-19-16-37(5)26(4)33(43)21-27-14-15-30(44)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,44H,6,10-11,16-21,23-24H2,1-5H3,(H2,39,40)(H,41,45)(H,42,46)/t26?,29?,32?,33?,37-,38+/m1/s1
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192n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091003
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-12-35(40)41-18-10-11-19-42-36(46)33(21-26(2)3)43-37(47)39(29-13-8-7-9-14-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h7-9,13-16,23,26-27,30,33-34,45H,6,10-12,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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204n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090989
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N6O3/c1-24(2)19-31(33(45)40-16-9-6-10-17-41-35(38)39)42-34(46)37(27-11-7-5-8-12-27)22-28(37)23-43-18-15-36(4)25(3)32(43)20-26-13-14-29(44)21-30(26)36/h5,7-8,11-14,21,24-25,28,31-32,44H,6,9-10,15-20,22-23H2,1-4H3,(H,40,45)(H,42,46)(H4,38,39,41)/t25?,28?,31?,32?,36-,37+/m1/s1
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216n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090992
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:30:29:39.33.32:24.26.25|
Show InChI InChI=1S/C38H55N5O3/c1-6-11-34(39)40-17-10-18-41-35(45)32(20-25(2)3)42-36(46)38(28-12-8-7-9-13-28)23-29(38)24-43-19-16-37(5)26(4)33(43)21-27-14-15-30(44)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,44H,6,10-11,16-21,23-24H2,1-5H3,(H2,39,40)(H,41,45)(H,42,46)/t26?,29?,32?,33?,37-,38+/m1/s1
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238n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50001267
PNG
(CHEMBL2364529)
Show SMILES COC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)[C@@H](C)C1Cc1ccc(O)cc21)c1ccccc1 |THB:14:13:23.17.16:8.10.9|
Show InChI InChI=1S/C26H31NO3/c1-17-23-13-18-9-10-21(28)14-22(18)25(17,2)11-12-27(23)16-20-15-26(20,24(29)30-3)19-7-5-4-6-8-19/h4-10,14,17,20,23,28H,11-13,15-16H2,1-3H3/t17-,20+,23?,25+,26-/m0/s1
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240n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50027808
PNG
((Dynorphin)2-[2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydro...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C46H72N14O10/c1-5-27(4)38(44(69)70)60-41(66)33(14-10-20-53-46(50)51)57-40(65)32(13-9-19-52-45(48)49)58-42(67)34(21-26(2)3)59-43(68)35(23-28-11-7-6-8-12-28)56-37(63)25-54-36(62)24-55-39(64)31(47)22-29-15-17-30(61)18-16-29/h6-8,11-12,15-18,26-27,31-35,38,61H,5,9-10,13-14,19-25,47H2,1-4H3,(H,54,62)(H,55,64)(H,56,63)(H,57,65)(H,58,67)(H,59,68)(H,60,66)(H,69,70)(H4,48,49,52)(H4,50,51,53)/t27-,31+,32+,33+,34+,35+,38+/m1/s1
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241n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor delta 1 are carried on crude membrane fractions obtained from the w...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091007
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N4O3/c1-25(2)20-32(34(43)39-18-11-6-5-10-17-38)40-35(44)37(28-12-8-7-9-13-28)23-29(37)24-41-19-16-36(4)26(3)33(41)21-27-14-15-30(42)22-31(27)36/h7-9,12-15,22,25-26,29,32-33,42H,5-6,10-11,16-21,23-24,38H2,1-4H3,(H,39,43)(H,40,44)/t26?,29?,32?,33?,36-,37+/m1/s1
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242n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090999
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N5O4/c1-25(2)19-32(35(46)40-17-10-6-9-16-39)42-34(45)23-41-36(47)38(28-11-7-5-8-12-28)22-29(38)24-43-18-15-37(4)26(3)33(43)20-27-13-14-30(44)21-31(27)37/h5,7-8,11-14,21,25-26,29,32-33,44H,6,9-10,15-20,22-24,39H2,1-4H3,(H,40,46)(H,41,47)(H,42,45)/t26?,29?,32?,33?,37-,38+/m1/s1
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246n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091010
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C36H52N6O3/c1-23(2)18-30(32(44)39-15-8-9-16-40-34(37)38)41-33(45)36(26-10-6-5-7-11-26)21-27(36)22-42-17-14-35(4)24(3)31(42)19-25-12-13-28(43)20-29(25)35/h5-7,10-13,20,23-24,27,30-31,43H,8-9,14-19,21-22H2,1-4H3,(H,39,44)(H,41,45)(H4,37,38,40)/t24?,27?,30?,31?,35-,36+/m1/s1
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250n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091025
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:29:28:38.32.31:23.25.24|
Show InChI InChI=1S/C37H53N5O3/c1-6-33(38)39-16-10-17-40-34(44)31(19-24(2)3)41-35(45)37(27-11-8-7-9-12-27)22-28(37)23-42-18-15-36(5)25(4)32(42)20-26-13-14-29(43)21-30(26)36/h7-9,11-14,21,24-25,28,31-32,43H,6,10,15-20,22-23H2,1-5H3,(H2,38,39)(H,40,44)(H,41,45)/t25?,28?,31?,32?,36-,37+/m1/s1
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254n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091013
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C39H56N6O4/c1-6-34(40)41-16-10-17-42-36(48)32(19-25(2)3)44-35(47)23-43-37(49)39(28-11-8-7-9-12-28)22-29(39)24-45-18-15-38(5)26(4)33(45)20-27-13-14-30(46)21-31(27)38/h7-9,11-14,21,25-26,29,32-33,46H,6,10,15-20,22-24H2,1-5H3,(H2,40,41)(H,42,48)(H,43,49)(H,44,47)/t26?,29?,32?,33?,38-,39+/m1/s1
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256n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091020
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N5O4/c1-24(2)18-31(34(45)39-16-9-8-15-38)41-33(44)22-40-35(46)37(27-10-6-5-7-11-27)21-28(37)23-42-17-14-36(4)25(3)32(42)19-26-12-13-29(43)20-30(26)36/h5-7,10-13,20,24-25,28,31-32,43H,8-9,14-19,21-23,38H2,1-4H3,(H,39,45)(H,40,46)(H,41,44)/t25?,28?,31?,32?,36-,37+/m1/s1
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270n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091022
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C36H52N4O3/c1-24(2)19-31(33(42)38-17-10-6-9-16-37)39-34(43)36(27-11-7-5-8-12-27)22-28(36)23-40-18-15-35(4)25(3)32(40)20-26-13-14-29(41)21-30(26)35/h5,7-8,11-14,21,24-25,28,31-32,41H,6,9-10,15-20,22-23,37H2,1-4H3,(H,38,42)(H,39,43)/t25?,28?,31?,32?,35-,36+/m1/s1
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277n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091023
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C35H50N6O3/c1-22(2)17-29(31(43)38-14-8-15-39-33(36)37)40-32(44)35(25-9-6-5-7-10-25)20-26(35)21-41-16-13-34(4)23(3)30(41)18-24-11-12-27(42)19-28(24)34/h5-7,9-12,19,22-23,26,29-30,42H,8,13-18,20-21H2,1-4H3,(H,38,43)(H,40,44)(H4,36,37,39)/t23?,26?,29?,30?,34-,35+/m1/s1
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280n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50090998
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C36H51N5O4/c1-23(2)17-30(33(44)38-15-8-14-37)40-32(43)21-39-34(45)36(26-9-6-5-7-10-26)20-27(36)22-41-16-13-35(4)24(3)31(41)18-25-11-12-28(42)19-29(25)35/h5-7,9-12,19,23-24,27,30-31,42H,8,13-18,20-22,37H2,1-4H3,(H,38,44)(H,39,45)(H,40,43)/t24?,27?,30?,31?,35-,36+/m1/s1
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282n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091024
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C34H48N4O3/c1-22(2)17-29(31(40)36-15-8-14-35)37-32(41)34(25-9-6-5-7-10-25)20-26(34)21-38-16-13-33(4)23(3)30(38)18-24-11-12-27(39)19-28(24)33/h5-7,9-12,19,22-23,26,29-30,39H,8,13-18,20-21,35H2,1-4H3,(H,36,40)(H,37,41)/t23?,26?,29?,30?,33-,34+/m1/s1
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367n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Kappa-type opioid receptor


(Cavia porcellus (domestic guinea pig))
BDBM50091019
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C35H50N4O3/c1-23(2)18-30(32(41)37-16-9-8-15-36)38-33(42)35(26-10-6-5-7-11-26)21-27(35)22-39-17-14-34(4)24(3)31(39)19-25-12-13-28(40)20-29(25)34/h5-7,10-13,20,23-24,27,30-31,40H,8-9,14-19,21-22,36H2,1-4H3,(H,37,41)(H,38,42)/t24?,27?,30?,31?,34-,35+/m1/s1
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382n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]-U-69,593 from Opioid receptor kappa 1 in guinea pig cerebellar.


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H | US1149237...)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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716n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor mu 1 was carried on crude membrane fractions obtained from the whol...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50027808
PNG
((Dynorphin)2-[2-(2-{2-[2-(2-{2-[2-Amino-3-(4-hydro...)
Show SMILES CC[C@@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)Cc1ccc(O)cc1)C(O)=O
Show InChI InChI=1S/C46H72N14O10/c1-5-27(4)38(44(69)70)60-41(66)33(14-10-20-53-46(50)51)57-40(65)32(13-9-19-52-45(48)49)58-42(67)34(21-26(2)3)59-43(68)35(23-28-11-7-6-8-12-28)56-37(63)25-54-36(62)24-55-39(64)31(47)22-29-15-17-30(61)18-16-29/h6-8,11-12,15-18,26-27,31-35,38,61H,5,9-10,13-14,19-25,47H2,1-4H3,(H,54,62)(H,55,64)(H,56,63)(H,57,65)(H,58,67)(H,59,68)(H,60,66)(H,69,70)(H4,48,49,52)(H4,50,51,53)/t27-,31+,32+,33+,34+,35+,38+/m1/s1
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1.35E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor mu 1 was carried on crude membrane fractions obtained from the whol...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091000
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-14-37(42)43-20-12-7-8-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-15-10-9-11-16-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h9-11,15-18,25,28-29,32,35-36,47H,6-8,12-14,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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1.90E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090997
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-13-36(41)42-19-11-8-12-20-43-37(47)34(22-27(2)3)44-38(48)40(30-14-9-7-10-15-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h7,9-10,14-17,24,27-28,31,34-35,46H,6,8,11-13,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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2.00E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090995
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-7-15-36(41)42-19-11-12-20-43-37(47)34(22-27(2)3)44-38(48)40(30-13-9-8-10-14-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h8-10,13-14,16-17,24,27-28,31,34-35,46H,6-7,11-12,15,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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2.13E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091002
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:38:37:47.41.40:32.34.33|
Show InChI InChI=1S/C44H66N6O4/c1-6-7-17-39(45)46-21-13-8-9-14-22-47-41(53)37(24-30(2)3)49-40(52)28-48-42(54)44(33-15-11-10-12-16-33)27-34(44)29-50-23-20-43(5)31(4)38(50)25-32-18-19-35(51)26-36(32)43/h10-12,15-16,18-19,26,30-31,34,37-38,51H,6-9,13-14,17,20-25,27-29H2,1-5H3,(H2,45,46)(H,47,53)(H,48,54)(H,49,52)/t31?,34?,37?,38?,43-,44+/m1/s1
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2.15E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091027
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:30:29:39.33.32:24.26.25|
Show InChI InChI=1S/C38H55N5O3/c1-6-34(39)40-17-10-11-18-41-35(45)32(20-25(2)3)42-36(46)38(28-12-8-7-9-13-28)23-29(38)24-43-19-16-37(5)26(4)33(43)21-27-14-15-30(44)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,44H,6,10-11,16-21,23-24H2,1-5H3,(H2,39,40)(H,41,45)(H,42,46)/t26?,29?,32?,33?,37-,38+/m1/s1
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2.20E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091012
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-35(40)41-18-11-8-12-19-42-36(46)33(21-26(2)3)43-37(47)39(29-13-9-7-10-14-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h7,9-10,13-16,23,26-27,30,33-34,45H,6,8,11-12,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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2.21E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091002
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:38:37:47.41.40:32.34.33|
Show InChI InChI=1S/C44H66N6O4/c1-6-7-17-39(45)46-21-13-8-9-14-22-47-41(53)37(24-30(2)3)49-40(52)28-48-42(54)44(33-15-11-10-12-16-33)27-34(44)29-50-23-20-43(5)31(4)38(50)25-32-18-19-35(51)26-36(32)43/h10-12,15-16,18-19,26,30-31,34,37-38,51H,6-9,13-14,17,20-25,27-29H2,1-5H3,(H2,45,46)(H,47,53)(H,48,54)(H,49,52)/t31?,34?,37?,38?,43-,44+/m1/s1
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2.23E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091005
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-7-14-35(40)41-18-11-19-42-36(46)33(21-26(2)3)43-37(47)39(29-12-9-8-10-13-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h8-10,12-13,15-16,23,26-27,30,33-34,45H,6-7,11,14,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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2.23E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090993
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C42H63N5O3/c1-6-7-17-38(43)44-21-13-8-9-14-22-45-39(49)36(24-29(2)3)46-40(50)42(32-15-11-10-12-16-32)27-33(42)28-47-23-20-41(5)30(4)37(47)25-31-18-19-34(48)26-35(31)41/h10-12,15-16,18-19,26,29-30,33,36-37,48H,6-9,13-14,17,20-25,27-28H2,1-5H3,(H2,43,44)(H,45,49)(H,46,50)/t30?,33?,36?,37?,41-,42+/m1/s1
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2.26E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091006
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-14-38(44)45-20-12-7-8-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-15-10-9-11-16-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h9-11,15-18,25,29-30,33,36-37,50H,6-8,12-14,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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2.27E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091003
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:31:30:40.34.33:25.27.26|
Show InChI InChI=1S/C39H57N5O3/c1-6-12-35(40)41-18-10-11-19-42-36(46)33(21-26(2)3)43-37(47)39(29-13-8-7-9-14-29)24-30(39)25-44-20-17-38(5)27(4)34(44)22-28-15-16-31(45)23-32(28)38/h7-9,13-16,23,26-27,30,33-34,45H,6,10-12,17-22,24-25H2,1-5H3,(H2,40,41)(H,42,46)(H,43,47)/t27?,30?,33?,34?,38-,39+/m1/s1
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2.28E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091001
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:37:38:43:53.47.46,THB:52:53:43:38.40.39|
Show InChI InChI=1S/C46H69N11O7/c1-6-27(2)38(41(62)64-5)56-40(61)35(15-11-20-52-44(49)50)55-39(60)34(14-10-19-51-43(47)48)54-37(59)25-53-42(63)46(30-12-8-7-9-13-30)24-31(46)26-57-21-18-45(4)28(3)36(57)22-29-16-17-32(58)23-33(29)45/h7-9,12-13,16-17,23,27-28,31,34-36,38,58H,6,10-11,14-15,18-22,24-26H2,1-5H3,(H,53,63)(H,54,59)(H,55,60)(H,56,61)(H4,47,48,51)(H4,49,50,52)/t27-,28?,31?,34-,35-,36?,38-,45+,46-/m0/s1
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2.30E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091015
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-7-16-37(42)43-20-12-9-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-14-10-8-11-15-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h8,10-11,14-15,17-18,25,28-29,32,35-36,47H,6-7,9,12-13,16,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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2.38E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091006
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-14-38(44)45-20-12-7-8-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-15-10-9-11-16-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h9-11,15-18,25,29-30,33,36-37,50H,6-8,12-14,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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2.43E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091023
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C35H50N6O3/c1-22(2)17-29(31(43)38-14-8-15-39-33(36)37)40-32(44)35(25-9-6-5-7-10-25)20-26(35)21-41-16-13-34(4)23(3)30(41)18-24-11-12-27(42)19-28(24)34/h5-7,9-12,19,22-23,26,29-30,42H,8,13-18,20-21H2,1-4H3,(H,38,43)(H,40,44)(H4,36,37,39)/t23?,26?,29?,30?,34-,35+/m1/s1
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2.43E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090990
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-7-16-38(44)45-20-12-9-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-14-10-8-11-15-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h8,10-11,14-15,17-18,25,29-30,33,36-37,50H,6-7,9,12-13,16,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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2.53E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091008
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C38H56N6O3/c1-25(2)20-32(34(46)41-17-10-5-6-11-18-42-36(39)40)43-35(47)38(28-12-8-7-9-13-28)23-29(38)24-44-19-16-37(4)26(3)33(44)21-27-14-15-30(45)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,45H,5-6,10-11,16-21,23-24H2,1-4H3,(H,41,46)(H,43,47)(H4,39,40,42)/t26?,29?,32?,33?,37-,38+/m1/s1
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2.63E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090990
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:37:36:46.40.39:31.33.32|
Show InChI InChI=1S/C43H64N6O4/c1-6-7-16-38(44)45-20-12-9-13-21-46-40(52)36(23-29(2)3)48-39(51)27-47-41(53)43(32-14-10-8-11-15-32)26-33(43)28-49-22-19-42(5)30(4)37(49)24-31-17-18-34(50)25-35(31)42/h8,10-11,14-15,17-18,25,29-30,33,36-37,50H,6-7,9,12-13,16,19-24,26-28H2,1-5H3,(H2,44,45)(H,46,52)(H,47,53)(H,48,51)/t30?,33?,36?,37?,42-,43+/m1/s1
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2.75E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090989
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N6O3/c1-24(2)19-31(33(45)40-16-9-6-10-17-41-35(38)39)42-34(46)37(27-11-7-5-8-12-27)22-28(37)23-43-18-15-36(4)25(3)32(43)20-26-13-14-29(44)21-30(26)36/h5,7-8,11-14,21,24-25,28,31-32,44H,6,9-10,15-20,22-23H2,1-4H3,(H,40,45)(H,42,46)(H4,38,39,41)/t25?,28?,31?,32?,36-,37+/m1/s1
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2.79E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091008
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C38H56N6O3/c1-25(2)20-32(34(46)41-17-10-5-6-11-18-42-36(39)40)43-35(47)38(28-12-8-7-9-13-28)23-29(38)24-44-19-16-37(4)26(3)33(44)21-27-14-15-30(45)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,45H,5-6,10-11,16-21,23-24H2,1-4H3,(H,41,46)(H,43,47)(H4,39,40,42)/t26?,29?,32?,33?,37-,38+/m1/s1
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2.83E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091021
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-36(41)42-19-12-7-8-13-20-43-37(47)34(22-27(2)3)44-38(48)40(30-14-10-9-11-15-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h9-11,14-17,24,27-28,31,34-35,46H,6-8,12-13,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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2.94E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091010
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCNC(N)=N |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C36H52N6O3/c1-23(2)18-30(32(44)39-15-8-9-16-40-34(37)38)41-33(45)36(26-10-6-5-7-11-26)21-27(36)22-42-17-14-35(4)24(3)31(42)19-25-12-13-28(43)20-29(25)35/h5-7,10-13,20,23-24,27,30-31,43H,8-9,14-19,21-22H2,1-4H3,(H,39,44)(H,41,45)(H4,37,38,40)/t24?,27?,30?,31?,35-,36+/m1/s1
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2.95E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090991
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C40H59N7O4/c1-26(2)20-33(36(50)43-17-10-5-6-11-18-44-38(41)42)46-35(49)24-45-37(51)40(29-12-8-7-9-13-29)23-30(40)25-47-19-16-39(4)27(3)34(47)21-28-14-15-31(48)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,48H,5-6,10-11,16-21,23-25H2,1-4H3,(H,43,50)(H,45,51)(H,46,49)(H4,41,42,44)/t27?,30?,33?,34?,39-,40+/m1/s1
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2.99E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091007
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N4O3/c1-25(2)20-32(34(43)39-18-11-6-5-10-17-38)40-35(44)37(28-12-8-7-9-13-28)23-29(37)24-41-19-16-36(4)26(3)33(41)21-27-14-15-30(42)22-31(27)36/h7-9,12-15,22,25-26,29,32-33,42H,5-6,10-11,16-21,23-24,38H2,1-4H3,(H,39,43)(H,40,44)/t26?,29?,32?,33?,36-,37+/m1/s1
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3.08E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091022
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C36H52N4O3/c1-24(2)19-31(33(42)38-17-10-6-9-16-37)39-34(43)36(27-11-7-5-8-12-27)22-28(36)23-40-18-15-35(4)25(3)32(40)20-26-13-14-29(41)21-30(26)35/h5,7-8,11-14,21,24-25,28,31-32,41H,6,9-10,15-20,22-23,37H2,1-4H3,(H,38,42)(H,39,43)/t25?,28?,31?,32?,35-,36+/m1/s1
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3.25E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090993
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C42H63N5O3/c1-6-7-17-38(43)44-21-13-8-9-14-22-45-39(49)36(24-29(2)3)46-40(50)42(32-15-11-10-12-16-32)27-33(42)28-47-23-20-41(5)30(4)37(47)25-31-18-19-34(48)26-35(31)41/h10-12,15-16,18-19,26,29-30,33,36-37,48H,6-9,13-14,17,20-25,27-28H2,1-5H3,(H2,43,44)(H,45,49)(H,46,50)/t30?,33?,36?,37?,41-,42+/m1/s1
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3.26E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091014
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-7-15-37(43)44-19-11-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-13-9-8-10-14-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h8-10,13-14,16-17,24,28-29,32,35-36,49H,6-7,11-12,15,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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3.31E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090991
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C40H59N7O4/c1-26(2)20-33(36(50)43-17-10-5-6-11-18-44-38(41)42)46-35(49)24-45-37(51)40(29-12-8-7-9-13-29)23-30(40)25-47-19-16-39(4)27(3)34(47)21-28-14-15-31(48)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,48H,5-6,10-11,16-21,23-25H2,1-4H3,(H,43,50)(H,45,51)(H,46,49)(H4,41,42,44)/t27?,30?,33?,34?,39-,40+/m1/s1
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3.35E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091019
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C35H50N4O3/c1-23(2)18-30(32(41)37-16-9-8-15-36)38-33(42)35(26-10-6-5-7-11-26)21-27(35)22-39-17-14-34(4)24(3)31(39)19-25-12-13-28(40)20-29(25)34/h5-7,10-13,20,23-24,27,30-31,40H,8-9,14-19,21-22,36H2,1-4H3,(H,37,41)(H,38,42)/t24?,27?,30?,31?,34-,35+/m1/s1
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3.40E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091007
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C37H54N4O3/c1-25(2)20-32(34(43)39-18-11-6-5-10-17-38)40-35(44)37(28-12-8-7-9-13-28)23-29(37)24-41-19-16-36(4)26(3)33(41)21-27-14-15-30(42)22-31(27)36/h7-9,12-15,22,25-26,29,32-33,42H,5-6,10-11,16-21,23-24,38H2,1-4H3,(H,39,43)(H,40,44)/t26?,29?,32?,33?,36-,37+/m1/s1
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3.42E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091000
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-14-37(42)43-20-12-7-8-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-15-10-9-11-16-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h9-11,15-18,25,28-29,32,35-36,47H,6-8,12-14,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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3.46E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091011
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-7-14-36(42)43-18-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-12-9-8-10-13-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h8-10,12-13,15-16,23,27-28,31,34-35,48H,6-7,11,14,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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3.46E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090987
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N7O4/c1-25(2)19-32(35(49)42-16-9-6-10-17-43-37(40)41)45-34(48)23-44-36(50)39(28-11-7-5-8-12-28)22-29(39)24-46-18-15-38(4)26(3)33(46)20-27-13-14-30(47)21-31(27)38/h5,7-8,11-14,21,25-26,29,32-33,47H,6,9-10,15-20,22-24H2,1-4H3,(H,42,49)(H,44,50)(H,45,48)(H4,40,41,43)/t26?,29?,32?,33?,38-,39+/m1/s1
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3.48E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091016
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N7O4/c1-24(2)18-31(34(48)41-15-8-9-16-42-36(39)40)44-33(47)22-43-35(49)38(27-10-6-5-7-11-27)21-28(38)23-45-17-14-37(4)25(3)32(45)19-26-12-13-29(46)20-30(26)37/h5-7,10-13,20,24-25,28,31-32,46H,8-9,14-19,21-23H2,1-4H3,(H,41,48)(H,43,49)(H,44,47)(H4,39,40,42)/t25?,28?,31?,32?,37-,38+/m1/s1
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3.50E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091021
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:32:31:41.35.34:26.28.27|
Show InChI InChI=1S/C40H59N5O3/c1-6-36(41)42-19-12-7-8-13-20-43-37(47)34(22-27(2)3)44-38(48)40(30-14-10-9-11-15-30)25-31(40)26-45-21-18-39(5)28(4)35(45)23-29-16-17-32(46)24-33(29)39/h9-11,14-17,24,27-28,31,34-35,46H,6-8,12-13,18-23,25-26H2,1-5H3,(H2,41,42)(H,43,47)(H,44,48)/t28?,31?,34?,35?,39-,40+/m1/s1
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3.55E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090992
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:30:29:39.33.32:24.26.25|
Show InChI InChI=1S/C38H55N5O3/c1-6-11-34(39)40-17-10-18-41-35(45)32(20-25(2)3)42-36(46)38(28-12-8-7-9-13-28)23-29(38)24-43-19-16-37(5)26(4)33(43)21-27-14-15-30(44)22-31(27)37/h7-9,12-15,22,25-26,29,32-33,44H,6,10-11,16-21,23-24H2,1-5H3,(H2,39,40)(H,41,45)(H,42,46)/t26?,29?,32?,33?,37-,38+/m1/s1
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3.57E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091015
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C41H61N5O3/c1-6-7-16-37(42)43-20-12-9-13-21-44-38(48)35(23-28(2)3)45-39(49)41(31-14-10-8-11-15-31)26-32(41)27-46-22-19-40(5)29(4)36(46)24-30-17-18-33(47)25-34(30)40/h8,10-11,14-15,17-18,25,28-29,32,35-36,47H,6-7,9,12-13,16,19-24,26-27H2,1-5H3,(H2,42,43)(H,44,48)(H,45,49)/t29?,32?,35?,36?,40-,41+/m1/s1
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3.59E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091014
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-7-15-37(43)44-19-11-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-13-9-8-10-14-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h8-10,13-14,16-17,24,28-29,32,35-36,49H,6-7,11-12,15,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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3.66E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090996
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N7O4/c1-23(2)17-30(33(47)40-14-8-15-41-35(38)39)43-32(46)21-42-34(48)37(26-9-6-5-7-10-26)20-27(37)22-44-16-13-36(4)24(3)31(44)18-25-11-12-28(45)19-29(25)36/h5-7,9-12,19,23-24,27,30-31,45H,8,13-18,20-22H2,1-4H3,(H,40,47)(H,42,48)(H,43,46)(H4,38,39,41)/t24?,27?,30?,31?,36-,37+/m1/s1
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3.72E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090987
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N7O4/c1-25(2)19-32(35(49)42-16-9-6-10-17-43-37(40)41)45-34(48)23-44-36(50)39(28-11-7-5-8-12-28)22-29(39)24-46-18-15-38(4)26(3)33(46)20-27-13-14-30(47)21-31(27)38/h5,7-8,11-14,21,25-26,29,32-33,47H,6,9-10,15-20,22-24H2,1-4H3,(H,42,49)(H,44,50)(H,45,48)(H4,40,41,43)/t26?,29?,32?,33?,38-,39+/m1/s1
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3.85E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091018
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-37(43)44-19-12-7-8-13-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-10-9-11-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h9-11,14-17,24,28-29,32,35-36,49H,6-8,12-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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4.21E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091024
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCN |TLB:18:17:27.21.20:12.14.13|
Show InChI InChI=1S/C34H48N4O3/c1-22(2)17-29(31(40)36-15-8-14-35)37-32(41)34(25-9-6-5-7-10-25)20-26(34)21-38-16-13-33(4)23(3)30(38)18-24-11-12-27(39)19-28(24)33/h5-7,9-12,19,22-23,26,29-30,39H,8,13-18,20-21,35H2,1-4H3,(H,36,40)(H,37,41)/t23?,26?,29?,30?,33-,34+/m1/s1
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4.22E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091009
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:33:34:39:49.43.42,THB:48:49:39:34.36.35|
Show InChI InChI=1S/C44H66N10O6/c1-6-26(2)36(39(58)60-5)53-38(57)33(14-10-19-49-41(45)46)51-37(56)34(15-11-20-50-42(47)48)52-40(59)44(29-12-8-7-9-13-29)24-30(44)25-54-21-18-43(4)27(3)35(54)22-28-16-17-31(55)23-32(28)43/h7-9,12-13,16-17,23,26-27,30,33-36,55H,6,10-11,14-15,18-22,24-25H2,1-5H3,(H,51,56)(H,52,59)(H,53,57)(H4,45,46,49)(H4,47,48,50)/t26-,27?,30+,33-,34-,35?,36-,43+,44-/m0/s1
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4.60E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090988
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-36(42)43-18-11-8-12-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-9-7-10-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7,9-10,13-16,23,27-28,31,34-35,48H,6,8,11-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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4.82E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091011
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-7-14-36(42)43-18-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-12-9-8-10-13-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h8-10,12-13,15-16,23,27-28,31,34-35,48H,6-7,11,14,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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4.95E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091025
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:29:28:38.32.31:23.25.24|
Show InChI InChI=1S/C37H53N5O3/c1-6-33(38)39-16-10-17-40-34(44)31(19-24(2)3)41-35(45)37(27-11-8-7-9-12-27)22-28(37)23-42-18-15-36(5)25(4)32(42)20-26-13-14-29(43)21-30(26)36/h7-9,11-14,21,24-25,28,31-32,43H,6,10,15-20,22-23H2,1-5H3,(H2,38,39)(H,40,44)(H,41,45)/t25?,28?,31?,32?,36-,37+/m1/s1
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4.98E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091018
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-37(43)44-19-12-7-8-13-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-10-9-11-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h9-11,14-17,24,28-29,32,35-36,49H,6-8,12-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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5.06E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090994
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-13-37(43)44-19-11-8-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-9-7-10-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h7,9-10,14-17,24,28-29,32,35-36,49H,6,8,11-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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5.21E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090988
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-36(42)43-18-11-8-12-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-9-7-10-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7,9-10,13-16,23,27-28,31,34-35,48H,6,8,11-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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5.58E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091028
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N5O4/c1-26(2)20-33(36(47)41-18-11-6-5-10-17-40)43-35(46)24-42-37(48)39(29-12-8-7-9-13-29)23-30(39)25-44-19-16-38(4)27(3)34(44)21-28-14-15-31(45)22-32(28)38/h7-9,12-15,22,26-27,30,33-34,45H,5-6,10-11,16-21,23-25,40H2,1-4H3,(H,41,47)(H,42,48)(H,43,46)/t27?,30?,33?,34?,38-,39+/m1/s1
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6.05E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091016
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N7O4/c1-24(2)18-31(34(48)41-15-8-9-16-42-36(39)40)44-33(47)22-43-35(49)38(27-10-6-5-7-11-27)21-28(38)23-45-17-14-37(4)25(3)32(45)19-26-12-13-29(46)20-30(26)37/h5-7,10-13,20,24-25,28,31-32,46H,8-9,14-19,21-23H2,1-4H3,(H,41,48)(H,43,49)(H,44,47)(H4,39,40,42)/t25?,28?,31?,32?,37-,38+/m1/s1
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6.16E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091004
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-12-36(42)43-18-10-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-8-7-9-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7-9,13-16,23,27-28,31,34-35,48H,6,10-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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6.78E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090994
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:36:35:45.39.38:30.32.31|
Show InChI InChI=1S/C42H62N6O4/c1-6-13-37(43)44-19-11-8-12-20-45-39(51)35(22-28(2)3)47-38(50)26-46-40(52)42(31-14-9-7-10-15-31)25-32(42)27-48-21-18-41(5)29(4)36(48)23-30-16-17-33(49)24-34(30)41/h7,9-10,14-17,24,28-29,32,35-36,49H,6,8,11-13,18-23,25-27H2,1-5H3,(H2,43,44)(H,45,51)(H,46,52)(H,47,50)/t29?,32?,35?,36?,41-,42+/m1/s1
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7.19E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091004
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:35:34:44.38.37:29.31.30|
Show InChI InChI=1S/C41H60N6O4/c1-6-12-36(42)43-18-10-11-19-44-38(50)34(21-27(2)3)46-37(49)25-45-39(51)41(30-13-8-7-9-14-30)24-31(41)26-47-20-17-40(5)28(4)35(47)22-29-15-16-32(48)23-33(29)40/h7-9,13-16,23,27-28,31,34-35,48H,6,10-12,17-22,24-26H2,1-5H3,(H2,42,43)(H,44,50)(H,45,51)(H,46,49)/t28?,31?,34?,35?,40-,41+/m1/s1
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7.28E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091029
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-35(41)42-17-10-11-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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7.48E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091028
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C39H57N5O4/c1-26(2)20-33(36(47)41-18-11-6-5-10-17-40)43-35(46)24-42-37(48)39(29-12-8-7-9-13-29)23-30(39)25-44-19-16-38(4)27(3)34(44)21-28-14-15-31(45)22-32(28)38/h7-9,12-15,22,26-27,30,33-34,45H,5-6,10-11,16-21,23-25,40H2,1-4H3,(H,41,47)(H,42,48)(H,43,46)/t27?,30?,33?,34?,38-,39+/m1/s1
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8.07E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50000296
PNG
(CHEMBL441765 | CHEMBL482811 | U-50488H | US1149237...)
Show SMILES CN([C@@H]1CCCC[C@H]1N1CCCC1)C(=O)Cc1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C19H26Cl2N2O/c1-22(19(24)13-14-8-9-15(20)16(21)12-14)17-6-2-3-7-18(17)23-10-4-5-11-23/h8-9,12,17-18H,2-7,10-11,13H2,1H3/t17-,18-/m1/s1
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8.10E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor delta 1 are carried on crude membrane fractions obtained from the w...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090996
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCNC(N)=N |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N7O4/c1-23(2)17-30(33(47)40-14-8-15-41-35(38)39)43-32(46)21-42-34(48)37(26-9-6-5-7-10-26)20-27(37)22-44-16-13-36(4)24(3)31(44)18-25-11-12-28(45)19-29(25)36/h5-7,9-12,19,23-24,27,30-31,45H,8,13-18,20-22H2,1-4H3,(H,40,47)(H,42,48)(H,43,46)(H4,38,39,41)/t24?,27?,30?,31?,36-,37+/m1/s1
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9.24E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091017
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-11-35(41)42-17-10-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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9.54E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090999
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N5O4/c1-25(2)19-32(35(46)40-17-10-6-9-16-39)42-34(45)23-41-36(47)38(28-11-7-5-8-12-28)22-29(38)24-43-18-15-37(4)26(3)33(43)20-27-13-14-30(44)21-31(27)37/h5,7-8,11-14,21,25-26,29,32-33,44H,6,9-10,15-20,22-24,39H2,1-4H3,(H,40,46)(H,41,47)(H,42,45)/t26?,29?,32?,33?,37-,38+/m1/s1
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9.58E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091029
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-35(41)42-17-10-11-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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9.70E+3n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091013
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C39H56N6O4/c1-6-34(40)41-16-10-17-42-36(48)32(19-25(2)3)44-35(47)23-43-37(49)39(28-11-8-7-9-12-28)22-29(39)24-45-18-15-38(5)26(4)33(45)20-27-13-14-30(46)21-31(27)38/h7-9,11-14,21,25-26,29,32-33,46H,6,10,15-20,22-24H2,1-5H3,(H2,40,41)(H,42,48)(H,43,49)(H,44,47)/t26?,29?,32?,33?,38-,39+/m1/s1
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1.04E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091020
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N5O4/c1-24(2)18-31(34(45)39-16-9-8-15-38)41-33(44)22-40-35(46)37(27-10-6-5-7-11-27)21-28(37)23-42-17-14-36(4)25(3)32(42)19-26-12-13-29(43)20-30(26)36/h5-7,10-13,20,24-25,28,31-32,43H,8-9,14-19,21-23,38H2,1-4H3,(H,39,45)(H,40,46)(H,41,44)/t25?,28?,31?,32?,36-,37+/m1/s1
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1.05E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090998
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C36H51N5O4/c1-23(2)17-30(33(44)38-15-8-14-37)40-32(43)21-39-34(45)36(26-9-6-5-7-10-26)20-27(36)22-41-16-13-35(4)24(3)31(41)18-25-11-12-28(42)19-29(25)35/h5-7,9-12,19,23-24,27,30-31,42H,8,13-18,20-22,37H2,1-4H3,(H,38,44)(H,39,45)(H,40,43)/t24?,27?,30?,31?,35-,36+/m1/s1
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1.06E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091017
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:34:33:43.37.36:28.30.29|
Show InChI InChI=1S/C40H58N6O4/c1-6-11-35(41)42-17-10-18-43-37(49)33(20-26(2)3)45-36(48)24-44-38(50)40(29-12-8-7-9-13-29)23-30(40)25-46-19-16-39(5)27(4)34(46)21-28-14-15-31(47)22-32(28)39/h7-9,12-15,22,26-27,30,33-34,47H,6,10-11,16-21,23-25H2,1-5H3,(H2,41,42)(H,43,49)(H,44,50)(H,45,48)/t27?,30?,33?,34?,39-,40+/m1/s1
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1.07E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091013
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CCC(=N)NCCCNC(=O)C(CC(C)C)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1 |TLB:33:32:42.36.35:27.29.28|
Show InChI InChI=1S/C39H56N6O4/c1-6-34(40)41-16-10-17-42-36(48)32(19-25(2)3)44-35(47)23-43-37(49)39(28-11-8-7-9-12-28)22-29(39)24-45-18-15-38(5)26(4)33(45)20-27-13-14-30(46)21-31(27)38/h7-9,11-14,21,25-26,29,32-33,46H,6,10,15-20,22-24H2,1-5H3,(H2,40,41)(H,42,48)(H,43,49)(H,44,47)/t26?,29?,32?,33?,38-,39+/m1/s1
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1.09E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090999
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C38H55N5O4/c1-25(2)19-32(35(46)40-17-10-6-9-16-39)42-34(45)23-41-36(47)38(28-11-7-5-8-12-28)22-29(38)24-43-18-15-37(4)26(3)33(43)20-27-13-14-30(44)21-31(27)37/h5,7-8,11-14,21,25-26,29,32-33,44H,6,9-10,15-20,22-24,39H2,1-4H3,(H,40,46)(H,41,47)(H,42,45)/t26?,29?,32?,33?,37-,38+/m1/s1
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1.09E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091020
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C37H53N5O4/c1-24(2)18-31(34(45)39-16-9-8-15-38)41-33(44)22-40-35(46)37(27-10-6-5-7-11-27)21-28(37)23-42-17-14-36(4)25(3)32(42)19-26-12-13-29(43)20-30(26)36/h5-7,10-13,20,24-25,28,31-32,43H,8-9,14-19,21-23,38H2,1-4H3,(H,39,45)(H,40,46)(H,41,44)/t25?,28?,31?,32?,36-,37+/m1/s1
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1.32E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50090998
PNG
(2-(8-Hydroxy-6,11-dimethyl-1,2,5,6-tetrahydro-4H-2...)
Show SMILES CC(C)CC(NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)NCCCN |TLB:22:21:31.25.24:16.18.17|
Show InChI InChI=1S/C36H51N5O4/c1-23(2)17-30(33(44)38-15-8-14-37)40-32(43)21-39-34(45)36(26-9-6-5-7-10-26)20-27(36)22-41-16-13-35(4)24(3)31(41)18-25-11-12-28(42)19-29(25)35/h5-7,9-12,19,23-24,27,30-31,42H,8,13-18,20-22,37H2,1-4H3,(H,38,44)(H,39,45)(H,40,43)/t24?,27?,30?,31?,35-,36+/m1/s1
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1.61E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine from opioid receptor mu 1 on crude membrane fractions obtained from whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091009
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:33:34:39:49.43.42,THB:48:49:39:34.36.35|
Show InChI InChI=1S/C44H66N10O6/c1-6-26(2)36(39(58)60-5)53-38(57)33(14-10-19-49-41(45)46)51-37(56)34(15-11-20-50-42(47)48)52-40(59)44(29-12-8-7-9-13-29)24-30(44)25-54-21-18-43(4)27(3)35(54)22-28-16-17-31(55)23-32(28)43/h7-9,12-13,16-17,23,26-27,30,33-36,55H,6,10-11,14-15,18-22,24-25H2,1-5H3,(H,51,56)(H,52,59)(H,53,57)(H4,45,46,49)(H4,47,48,50)/t26-,27?,30+,33-,34-,35?,36-,43+,44-/m0/s1
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>2.50E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50001267
PNG
(CHEMBL2364529)
Show SMILES COC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)[C@@H](C)C1Cc1ccc(O)cc21)c1ccccc1 |THB:14:13:23.17.16:8.10.9|
Show InChI InChI=1S/C26H31NO3/c1-17-23-13-18-9-10-21(28)14-22(18)25(17,2)11-12-27(23)16-20-15-26(20,24(29)30-3)19-7-5-4-6-8-19/h4-10,14,17,20,23,28H,11-13,15-16H2,1-3H3/t17-,20+,23?,25+,26-/m0/s1
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>2.50E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor delta 1 are carried on crude membrane fractions obtained from the w...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Rattus norvegicus (rat))
BDBM50091001
PNG
(2-[5-Guanidino-2-(5-guanidino-2-{[2-(8-hydroxy-6,1...)
Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@]1(CC1CN1CC[C@]2(C)C(C)C1Cc1ccc(O)cc21)c1ccccc1)C(=O)OC |TLB:37:38:43:53.47.46,THB:52:53:43:38.40.39|
Show InChI InChI=1S/C46H69N11O7/c1-6-27(2)38(41(62)64-5)56-40(61)35(15-11-20-52-44(49)50)55-39(60)34(14-10-19-51-43(47)48)54-37(59)25-53-42(63)46(30-12-8-7-9-13-30)24-31(46)26-57-21-18-45(4)28(3)36(57)22-29-16-17-32(58)23-33(29)45/h7-9,12-13,16-17,23,27-28,31,34-36,38,58H,6,10-11,14-15,18-22,24-26H2,1-5H3,(H,53,63)(H,54,59)(H,55,60)(H,56,61)(H4,47,48,51)(H4,49,50,52)/t27-,28?,31?,34-,35-,36?,38-,45+,46-/m0/s1
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>2.50E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Displacement of [3H]diprenorphine opioid receptor delta 1 on crude membrane fractions obtained from the whole rat brain (minus cerebellum)


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50001267
PNG
(CHEMBL2364529)
Show SMILES COC(=O)[C@@]1(C[C@@H]1CN1CC[C@]2(C)[C@@H](C)C1Cc1ccc(O)cc21)c1ccccc1 |THB:14:13:23.17.16:8.10.9|
Show InChI InChI=1S/C26H31NO3/c1-17-23-13-18-9-10-21(28)14-22(18)25(17,2)11-12-27(23)16-20-15-26(20,24(29)30-3)19-7-5-4-6-8-19/h4-10,14,17,20,23,28H,11-13,15-16H2,1-3H3/t17-,20+,23?,25+,26-/m0/s1
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>2.50E+4n/an/an/an/an/an/an/an/a



University of Catania

Curated by ChEMBL


Assay Description
Tested for binding affinity by [3H]diprenorphine displacement for Opioid receptor mu 1 was carried on crude membrane fractions obtained from the whol...


J Med Chem 43: 2992-3004 (2000)


BindingDB Entry DOI: 10.7270/Q2862H5C
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%