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7 similar compounds to monomer 50369310

Compile data set for download or QSAR
Wt: 1177.2
BDBM50059839
Wt: 1032.1
BDBM50059837
Wt: 1204.2
BDBM50369309
Wt: 1009.0
BDBM50059838
Wt: 1085.1
BDBM50059834
Wt: 917.0
BDBM50059842
Wt: 847.9
BDBM50369572

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 14 hits for monomerid = 50059839,50059837,50369309,50059838,50059834,50059842,50369572   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50369309
PNG
(CHEMBL2369626)
Show SMILES C[C@@H](O[C@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(N)=O
Show InChI InChI=1S/C57H73N9O20/c1-29(62-52(76)40(58)23-36-14-18-38(71)19-15-36)51(75)64-41(24-35-11-8-7-9-12-35)53(77)61-27-46(74)63-42(25-37-16-20-39(72)21-17-37)56(80)66-22-10-13-43(66)54(78)65-47(55(79)60-26-45(59)73)30(2)82-57-50(85-34(6)70)49(84-33(5)69)48(83-32(4)68)44(86-57)28-81-31(3)67/h7-9,11-12,14-21,29-30,40-44,47-50,57,71-72H,10,13,22-28,58H2,1-6H3,(H2,59,73)(H,60,79)(H,61,77)(H,62,76)(H,63,74)(H,64,75)(H,65,78)/t29-,30-,40+,41+,42+,43+,44+,47+,48+,49-,50+,57+/m1/s1
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0.460n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50059837
PNG
(CHEMBL2370328 | Tyr-D-Ala-Phe-Asp-Val-Val-Thr[Beta...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)NCC(N)=O
Show InChI InChI=1S/C47H69N9O17/c1-21(2)34(45(70)55-35(22(3)4)46(71)56-36(44(69)50-19-32(49)59)24(6)72-47-39(64)38(63)37(62)31(20-57)73-47)54-43(68)30(18-33(60)61)53-42(67)29(17-25-10-8-7-9-11-25)52-40(65)23(5)51-41(66)28(48)16-26-12-14-27(58)15-13-26/h7-15,21-24,28-31,34-39,47,57-58,62-64H,16-20,48H2,1-6H3,(H2,49,59)(H,50,69)(H,51,66)(H,52,65)(H,53,67)(H,54,68)(H,55,70)(H,56,71)(H,60,61)/t23-,24-,28+,29+,30+,31-,34+,35+,36+,37-,38+,39-,47+/m1/s1
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1.60n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50369309
PNG
(CHEMBL2369626)
Show SMILES C[C@@H](O[C@H]1O[C@@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@@H]1OC(C)=O)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccc(O)cc1)NC(=O)CNC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(N)=O
Show InChI InChI=1S/C57H73N9O20/c1-29(62-52(76)40(58)23-36-14-18-38(71)19-15-36)51(75)64-41(24-35-11-8-7-9-12-35)53(77)61-27-46(74)63-42(25-37-16-20-39(72)21-17-37)56(80)66-22-10-13-43(66)54(78)65-47(55(79)60-26-45(59)73)30(2)82-57-50(85-34(6)70)49(84-33(5)69)48(83-32(4)68)44(86-57)28-81-31(3)67/h7-9,11-12,14-21,29-30,40-44,47-50,57,71-72H,10,13,22-28,58H2,1-6H3,(H2,59,73)(H,60,79)(H,61,77)(H,62,76)(H,63,74)(H,64,75)(H,65,78)/t29-,30-,40+,41+,42+,43+,44+,47+,48+,49-,50+,57+/m1/s1
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87n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50059837
PNG
(CHEMBL2370328 | Tyr-D-Ala-Phe-Asp-Val-Val-Thr[Beta...)
Show SMILES CC(C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)C(=O)NCC(N)=O
Show InChI InChI=1S/C47H69N9O17/c1-21(2)34(45(70)55-35(22(3)4)46(71)56-36(44(69)50-19-32(49)59)24(6)72-47-39(64)38(63)37(62)31(20-57)73-47)54-43(68)30(18-33(60)61)53-42(67)29(17-25-10-8-7-9-11-25)52-40(65)23(5)51-41(66)28(48)16-26-12-14-27(58)15-13-26/h7-15,21-24,28-31,34-39,47,57-58,62-64H,16-20,48H2,1-6H3,(H2,49,59)(H,50,69)(H,51,66)(H,52,65)(H,53,67)(H,54,68)(H,55,70)(H,56,71)(H,60,61)/t23-,24-,28+,29+,30+,31-,34+,35+,36+,37-,38+,39-,47+/m1/s1
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579n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50059834
PNG
(CHEMBL2370331 | Tyr-D-Ala-Phe-Thr[Beta-D-Glc(OAc)4...)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O[C@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C51H72N8O18/c1-24(2)39(48(69)54-22-38(53)65)57-49(70)40(25(3)4)58-50(71)41(27(6)73-51-44(76-31(10)63)43(75-30(9)62)42(74-29(8)61)37(77-51)23-72-28(7)60)59-47(68)36(21-32-14-12-11-13-15-32)56-45(66)26(5)55-46(67)35(52)20-33-16-18-34(64)19-17-33/h11-19,24-27,35-37,39-44,51,64H,20-23,52H2,1-10H3,(H2,53,65)(H,54,69)(H,55,67)(H,56,66)(H,57,70)(H,58,71)(H,59,68)/t26-,27-,35+,36+,37-,39+,40+,41+,42-,43+,44-,51+/m1/s1
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1.52E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50059838
PNG
(CHEMBL2370329 | Tyr-D-Ala-Phe-Thr(-D-Glc)-Tyr-Pro-...)
Show SMILES C[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
Show InChI InChI=1S/C48H64N8O16/c1-24(51-43(66)31(49)19-27-10-14-29(59)15-11-27)42(65)52-32(20-26-7-4-3-5-8-26)44(67)55-37(25(2)71-48-40(63)39(62)38(61)36(23-58)72-48)46(69)53-33(21-28-12-16-30(60)17-13-28)47(70)56-18-6-9-35(56)45(68)54-34(22-57)41(50)64/h3-5,7-8,10-17,24-25,31-40,48,57-63H,6,9,18-23,49H2,1-2H3,(H2,50,64)(H,51,66)(H,52,65)(H,53,69)(H,54,68)(H,55,67)/t24-,25-,31+,32+,33+,34+,35+,36-,37+,38-,39+,40-,48+/m1/s1
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1.70E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50059838
PNG
(CHEMBL2370329 | Tyr-D-Ala-Phe-Thr(-D-Glc)-Tyr-Pro-...)
Show SMILES C[C@@H](O[C@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
Show InChI InChI=1S/C48H64N8O16/c1-24(51-43(66)31(49)19-27-10-14-29(59)15-11-27)42(65)52-32(20-26-7-4-3-5-8-26)44(67)55-37(25(2)71-48-40(63)39(62)38(61)36(23-58)72-48)46(69)53-33(21-28-12-16-30(60)17-13-28)47(70)56-18-6-9-35(56)45(68)54-34(22-57)41(50)64/h3-5,7-8,10-17,24-25,31-40,48,57-63H,6,9,18-23,49H2,1-2H3,(H2,50,64)(H,51,66)(H,52,65)(H,53,69)(H,54,68)(H,55,67)/t24-,25-,31+,32+,33+,34+,35+,36-,37+,38-,39+,40-,48+/m1/s1
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1.76E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50059842
PNG
(2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylami...)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H64N8O14/c1-20(2)31(40(61)46-18-30(45)54)49-41(62)32(21(3)4)50-42(63)33(23(6)64-43-36(57)35(56)34(55)29(19-52)65-43)51-39(60)28(17-24-10-8-7-9-11-24)48-37(58)22(5)47-38(59)27(44)16-25-12-14-26(53)15-13-25/h7-15,20-23,27-29,31-36,43,52-53,55-57H,16-19,44H2,1-6H3,(H2,45,54)(H,46,61)(H,47,59)(H,48,58)(H,49,62)(H,50,63)(H,51,60)/t22-,23-,27+,28+,29-,31+,32+,33+,34-,35-,36-,43+/m1/s1
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1.99E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50059834
PNG
(CHEMBL2370331 | Tyr-D-Ala-Phe-Thr[Beta-D-Glc(OAc)4...)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O[C@H]1O[C@H](COC(C)=O)[C@@H](OC(C)=O)[C@H](OC(C)=O)[C@H]1OC(C)=O)C(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C51H72N8O18/c1-24(2)39(48(69)54-22-38(53)65)57-49(70)40(25(3)4)58-50(71)41(27(6)73-51-44(76-31(10)63)43(75-30(9)62)42(74-29(8)61)37(77-51)23-72-28(7)60)59-47(68)36(21-32-14-12-11-13-15-32)56-45(66)26(5)55-46(67)35(52)20-33-16-18-34(64)19-17-33/h11-19,24-27,35-37,39-44,51,64H,20-23,52H2,1-10H3,(H2,53,65)(H,54,69)(H,55,67)(H,56,66)(H,57,70)(H,58,71)(H,59,68)/t26-,27-,35+,36+,37-,39+,40+,41+,42-,43+,44-,51+/m1/s1
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2.11E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Nociceptin/mu opioid receptor


(Rattus norvegicus (rat))
BDBM50059839
PNG
(CHEMBL2370333 | Tyr-D-Ala-Phe-Thr[-D-Glc(OAc)4]-Ty...)
Show SMILES C[C@@H](O[C@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
Show InChI InChI=1S/C56H72N8O20/c1-28(59-51(74)39(57)23-35-14-18-37(70)19-15-35)50(73)60-40(24-34-11-8-7-9-12-34)52(75)63-45(29(2)80-56-48(83-33(6)69)47(82-32(5)68)46(81-31(4)67)44(84-56)27-79-30(3)66)54(77)61-41(25-36-16-20-38(71)21-17-36)55(78)64-22-10-13-43(64)53(76)62-42(26-65)49(58)72/h7-9,11-12,14-21,28-29,39-48,56,65,70-71H,10,13,22-27,57H2,1-6H3,(H2,58,72)(H,59,74)(H,60,73)(H,61,77)(H,62,76)(H,63,75)/t28-,29-,39+,40+,41+,42+,43+,44-,45+,46+,47-,48-,56+/m1/s1
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4.40E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor mu 1 binding affinity by displacement of radioligand [3H][DAla,MePhe,Gly-ol]enkephalin (DAGO) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50059842
PNG
(2-(2-{2-[2-Amino-3-(4-hydroxy-phenyl)-propionylami...)
Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O[C@H]1O[C@H](CO)[C@@H](O)[C@@H](O)[C@H]1O)C(C)C)C(=O)NCC(N)=O
Show InChI InChI=1S/C43H64N8O14/c1-20(2)31(40(61)46-18-30(45)54)49-41(62)32(21(3)4)50-42(63)33(23(6)64-43-36(57)35(56)34(55)29(19-52)65-43)51-39(60)28(17-24-10-8-7-9-11-24)48-37(58)22(5)47-38(59)27(44)16-25-12-14-26(53)15-13-25/h7-15,20-23,27-29,31-36,43,52-53,55-57H,16-19,44H2,1-6H3,(H2,45,54)(H,46,61)(H,47,59)(H,48,58)(H,49,62)(H,50,63)(H,51,60)/t22-,23-,27+,28+,29-,31+,32+,33+,34-,35-,36-,43+/m1/s1
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9.50E+3n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Opioid receptors; mu & delta


(Rattus norvegicus (rat))
BDBM50059839
PNG
(CHEMBL2370333 | Tyr-D-Ala-Phe-Thr[-D-Glc(OAc)4]-Ty...)
Show SMILES C[C@@H](O[C@H]1O[C@H](COC(C)=O)[C@H](OC(C)=O)[C@@H](OC(C)=O)[C@H]1OC(C)=O)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
Show InChI InChI=1S/C56H72N8O20/c1-28(59-51(74)39(57)23-35-14-18-37(70)19-15-35)50(73)60-40(24-34-11-8-7-9-12-34)52(75)63-45(29(2)80-56-48(83-33(6)69)47(82-32(5)68)46(81-31(4)67)44(84-56)27-79-30(3)66)54(77)61-41(25-36-16-20-38(71)21-17-36)55(78)64-22-10-13-43(64)53(76)62-42(26-65)49(58)72/h7-9,11-12,14-21,28-29,39-48,56,65,70-71H,10,13,22-27,57H2,1-6H3,(H2,58,72)(H,59,74)(H,60,73)(H,61,77)(H,62,76)(H,63,75)/t28-,29-,39+,40+,41+,42+,43+,44-,45+,46+,47-,48-,56+/m1/s1
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PubMed
2.26E+4n/an/an/an/an/an/an/an/a



University of Ferrara

Curated by ChEMBL


Assay Description
Opioid receptor delta 1 binding affinity by displacement of radioligand [3H][D-Pen]-enkephalin (DPDPE) from rat brain membrane synaptosomes


J Med Chem 40: 2948-52 (1997)


Article DOI: 10.1021/jm970119r
BindingDB Entry DOI: 10.7270/Q2BC406Q
More data for this
Ligand-Target Pair
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50369572
PNG
(CHEMBL1790709)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O)C(N)=O
Show InChI InChI=1S/C39H57N7O14/c1-19(2)13-25(36(56)45-27(34(41)54)18-59-39-33(53)32(52)31(51)28(17-47)60-39)44-37(57)26(15-21-7-5-4-6-8-21)43-29(50)16-42-38(58)30(20(3)48)46-35(55)24(40)14-22-9-11-23(49)12-10-22/h4-12,19-20,24-28,30-33,39,47-49,51-53H,13-18,40H2,1-3H3,(H2,41,54)(H,42,58)(H,43,50)(H,44,57)(H,45,56)(H,46,55)/t20-,24+,25+,26+,27+,28+,30-,31+,32-,33-,39+/m1/s1
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PubMed
n/an/a 3.40n/an/an/an/an/an/a



University of Northern Colorado

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor delta 1 was evaluated


J Med Chem 43: 2586-90 (2000)


Article DOI: 10.1021/jm000077y
BindingDB Entry DOI: 10.7270/Q2JQ11Q1
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50369572
PNG
(CHEMBL1790709)
Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)C(=O)N[C@@H](CO[C@H]1O[C@@H](CO)[C@H](O)[C@@H](O)[C@H]1O)C(N)=O
Show InChI InChI=1S/C39H57N7O14/c1-19(2)13-25(36(56)45-27(34(41)54)18-59-39-33(53)32(52)31(51)28(17-47)60-39)44-37(57)26(15-21-7-5-4-6-8-21)43-29(50)16-42-38(58)30(20(3)48)46-35(55)24(40)14-22-9-11-23(49)12-10-22/h4-12,19-20,24-28,30-33,39,47-49,51-53H,13-18,40H2,1-3H3,(H2,41,54)(H,42,58)(H,43,50)(H,44,57)(H,45,56)(H,46,55)/t20-,24+,25+,26+,27+,28+,30-,31+,32-,33-,39+/m1/s1
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PubMed
n/an/a 8.20n/an/an/an/an/an/a



University of Northern Colorado

Curated by ChEMBL


Assay Description
Binding affinity towards Opioid receptor mu 1 was evaluated


J Med Chem 43: 2586-90 (2000)


Article DOI: 10.1021/jm000077y
BindingDB Entry DOI: 10.7270/Q2JQ11Q1
More data for this
Ligand-Target Pair