Found 26 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252860
((S)-N-((S)-1,6-diamino-1-oxohexan-2-yl)-1-((S)-5-g...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(-[#8])cc1-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C66H109N21O12/c1-8-38(4)54(62(98)84-48(23-16-28-77-66(73)74)63(99)87-29-17-24-51(87)61(97)81-45(55(68)91)20-12-13-25-67)86-58(94)47(22-15-27-76-65(71)72)82-57(93)46(21-14-26-75-64(69)70)83-59(95)49(30-37(2)3)85-60(96)50(34-42-18-10-9-11-19-42)80-53(90)36-78-52(89)35-79-56(92)41(7)33-44-39(5)31-43(88)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54,88H,8,12-17,20-30,33-36,67H2,1-7H3,(H2,68,91)(H,78,89)(H,79,92)(H,80,90)(H,81,97)(H,82,93)(H,83,95)(H,84,98)(H,85,96)(H,86,94)(H4,69,70,75)(H4,71,72,76)(H4,73,74,77)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.823 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252855
((4S,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dimethyl-ph...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C30H37N7O8S2/c1-15-8-19(26(31)39)9-16(2)21(15)10-17(3)28(41)36-24-14-47-46-13-23(27(32)40)35-30(43)22(34-25(38)12-33-29(24)42)11-18-4-6-20(7-5-18)37(44)45/h4-9,17,22-24H,10-14H2,1-3H3,(H2,31,39)(H2,32,40)(H,33,42)(H,34,38)(H,35,43)(H,36,41)/t17-,22-,23+,24+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.02 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(GUINEA PIG) | BDBM50252864
(CHEMBL454035 | antanal 2)Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O |r| Show InChI InChI=1S/C38H43N5O5/c1-23-17-29(44)18-24(2)30(23)22-31(39)38(48)43-16-8-13-34(43)37(47)42-33(20-25-9-4-3-5-10-25)36(46)41-32(35(40)45)21-26-14-15-27-11-6-7-12-28(27)19-26/h3-7,9-12,14-15,17-19,31-34,44H,8,13,16,20-22,39H2,1-2H3,(H2,40,45)(H,41,46)(H,42,47)/t31-,32+,33-,34+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against mu opioid receptor in guinea pig ileum assessed as effect on TAPP-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252856
((4S,7S,13S)-13-[(S)-3-(4-Hydroxy-2,6-dimethyl-phen...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C29H36N6O8S2/c1-15-8-20(36)9-16(2)21(15)10-17(3)27(39)34-24-14-45-44-13-23(26(30)38)33-29(41)22(32-25(37)12-31-28(24)40)11-18-4-6-19(7-5-18)35(42)43/h4-9,17,22-24,36H,10-14H2,1-3H3,(H2,30,38)(H,31,40)(H,32,37)(H,33,41)(H,34,39)/t17-,22-,23+,24+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.23 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252858
((S)-2-({(4R,7S,13S)-7-(4-Fluoro-benzyl)-13-[(S)-3-...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C42H52FN5O8S2/c1-23-17-29(49)18-24(2)30(23)19-25(3)36(51)47-34-38(53)44-22-33(50)45-31(20-27-13-15-28(43)16-14-27)37(52)48-35(42(6,7)58-57-41(34,4)5)39(54)46-32(40(55)56)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35,49H,19-22H2,1-7H3,(H,44,53)(H,45,50)(H,46,54)(H,47,51)(H,48,52)(H,55,56)/t25-,31-,32-,34-,35+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.32 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(GUINEA PIG) | BDBM50252863
(CHEMBL507442 | antanal 1)Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O |r| Show InChI InChI=1S/C40H44N6O5/c1-23-16-29(47)17-24(2)31(23)21-32(41)40(51)46-15-7-12-36(46)39(50)45-35(20-28-22-43-33-11-6-5-10-30(28)33)38(49)44-34(37(42)48)19-25-13-14-26-8-3-4-9-27(26)18-25/h3-6,8-11,13-14,16-18,22,32,34-36,43,47H,7,12,15,19-21,41H2,1-2H3,(H2,42,48)(H,44,49)(H,45,50)/t32-,34+,35-,36+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against mu opioid receptor in guinea pig ileum assessed as effect on TAPP-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252857
((S)-2-{[(4R,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dim...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C43H53FN6O8S2/c1-23-17-28(36(45)52)18-24(2)30(23)19-25(3)37(53)49-34-39(55)46-22-33(51)47-31(20-27-13-15-29(44)16-14-27)38(54)50-35(43(6,7)60-59-42(34,4)5)40(56)48-32(41(57)58)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35H,19-22H2,1-7H3,(H2,45,52)(H,46,55)(H,47,51)(H,48,56)(H,49,53)(H,50,54)(H,57,58)/t25-,31-,32-,34-,35+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 2.92 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252856
((4S,7S,13S)-13-[(S)-3-(4-Hydroxy-2,6-dimethyl-phen...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C29H36N6O8S2/c1-15-8-20(36)9-16(2)21(15)10-17(3)27(39)34-24-14-45-44-13-23(26(30)38)33-29(41)22(32-25(37)12-31-28(24)40)11-18-4-6-19(7-5-18)35(42)43/h4-9,17,22-24,36H,10-14H2,1-3H3,(H2,30,38)(H,31,40)(H,32,37)(H,33,41)(H,34,39)/t17-,22-,23+,24+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.61 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(MOUSE) | BDBM50252864
(CHEMBL454035 | antanal 2)Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O |r| Show InChI InChI=1S/C38H43N5O5/c1-23-17-29(44)18-24(2)30(23)22-31(39)38(48)43-16-8-13-34(43)37(47)42-33(20-25-9-4-3-5-10-25)36(46)41-32(35(40)45)21-26-14-15-27-11-6-7-12-28(27)19-26/h3-7,9-12,14-15,17-19,31-34,44H,8,13,16,20-22,39H2,1-2H3,(H2,40,45)(H,41,46)(H,42,47)/t31-,32+,33-,34+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.74 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against delta opioid receptor in mouse vas deference assessed as effect on DPDPE-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(GUINEA PIG) | BDBM50252862
((5S,8S,14R)-8-Benzyl-14-[(S)-2-[3-(4-hydroxy-2,6-d...)Show SMILES Cc1cc(O)cc(C)c1CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCCCNC(=O)NC[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC1=O)C(O)=O |r| Show InChI InChI=1S/C41H51N7O10/c1-24-18-29(50)19-25(2)30(24)15-16-35(51)45-32(21-27-11-13-28(49)14-12-27)38(54)47-31-10-6-7-17-42-41(58)44-22-34(40(56)57)48-39(55)33(20-26-8-4-3-5-9-26)46-36(52)23-43-37(31)53/h3-5,8-9,11-14,18-19,31-34,49-50H,6-7,10,15-17,20-23H2,1-2H3,(H,43,53)(H,45,51)(H,46,52)(H,47,54)(H,48,55)(H,56,57)(H2,42,44,58)/t31-,32+,33+,34+/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 15.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against mu opioid receptor in guinea pig ileum assessed as effect on TAPP-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(MOUSE) | BDBM50252863
(CHEMBL507442 | antanal 1)Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccc2ccccc2c1)C(N)=O |r| Show InChI InChI=1S/C40H44N6O5/c1-23-16-29(47)17-24(2)31(23)21-32(41)40(51)46-15-7-12-36(46)39(50)45-35(20-28-22-43-33-11-6-5-10-30(28)33)38(49)44-34(37(42)48)19-25-13-14-26-8-3-4-9-27(26)18-25/h3-6,8-11,13-14,16-18,22,32,34-36,43,47H,7,12,15,19-21,41H2,1-2H3,(H2,42,48)(H,44,49)(H,45,50)/t32-,34+,35-,36+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 17.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against delta opioid receptor in mouse vas deference assessed as effect on DPDPE-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252855
((4S,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dimethyl-ph...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C30H37N7O8S2/c1-15-8-19(26(31)39)9-16(2)21(15)10-17(3)28(41)36-24-14-47-46-13-23(27(32)40)35-30(43)22(34-25(38)12-33-29(24)42)11-18-4-6-20(7-5-18)37(44)45/h4-9,17,22-24H,10-14H2,1-3H3,(H2,31,39)(H2,32,40)(H,33,42)(H,34,38)(H,35,43)(H,36,41)/t17-,22-,23+,24+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 19 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252859
((S)-1-((S)-2-((2S,3S)-2-((S)-2-((S)-2-((S)-2-((S)-...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(cc1-[#6])-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C67H110N22O12/c1-8-38(4)54(63(100)86-48(23-16-28-79-67(75)76)64(101)89-29-17-24-51(89)62(99)83-45(56(70)93)20-12-13-25-68)88-59(96)47(22-15-27-78-66(73)74)84-58(95)46(21-14-26-77-65(71)72)85-60(97)49(30-37(2)3)87-61(98)50(34-42-18-10-9-11-19-42)82-53(91)36-80-52(90)35-81-57(94)41(7)33-44-39(5)31-43(55(69)92)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54H,8,12-17,20-30,33-36,68H2,1-7H3,(H2,69,92)(H2,70,93)(H,80,90)(H,81,94)(H,82,91)(H,83,99)(H,84,95)(H,85,97)(H,86,100)(H,87,98)(H,88,96)(H4,71,72,77)(H4,73,74,78)(H4,75,76,79)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 26 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252859
((S)-1-((S)-2-((2S,3S)-2-((S)-2-((S)-2-((S)-2-((S)-...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(cc1-[#6])-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C67H110N22O12/c1-8-38(4)54(63(100)86-48(23-16-28-79-67(75)76)64(101)89-29-17-24-51(89)62(99)83-45(56(70)93)20-12-13-25-68)88-59(96)47(22-15-27-78-66(73)74)84-58(95)46(21-14-26-77-65(71)72)85-60(97)49(30-37(2)3)87-61(98)50(34-42-18-10-9-11-19-42)82-53(91)36-80-52(90)35-81-57(94)41(7)33-44-39(5)31-43(55(69)92)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54H,8,12-17,20-30,33-36,68H2,1-7H3,(H2,69,92)(H2,70,93)(H,80,90)(H,81,94)(H,82,91)(H,83,99)(H,84,95)(H,85,97)(H,86,100)(H,87,98)(H,88,96)(H4,71,72,77)(H4,73,74,78)(H4,75,76,79)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 27.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252859
((S)-1-((S)-2-((2S,3S)-2-((S)-2-((S)-2-((S)-2-((S)-...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(cc1-[#6])-[#6](-[#7])=O)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C67H110N22O12/c1-8-38(4)54(63(100)86-48(23-16-28-79-67(75)76)64(101)89-29-17-24-51(89)62(99)83-45(56(70)93)20-12-13-25-68)88-59(96)47(22-15-27-78-66(73)74)84-58(95)46(21-14-26-77-65(71)72)85-60(97)49(30-37(2)3)87-61(98)50(34-42-18-10-9-11-19-42)82-53(91)36-80-52(90)35-81-57(94)41(7)33-44-39(5)31-43(55(69)92)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54H,8,12-17,20-30,33-36,68H2,1-7H3,(H2,69,92)(H2,70,93)(H,80,90)(H,81,94)(H,82,91)(H,83,99)(H,84,95)(H,85,97)(H,86,100)(H,87,98)(H,88,96)(H4,71,72,77)(H4,73,74,78)(H4,75,76,79)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 29.6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252856
((4S,7S,13S)-13-[(S)-3-(4-Hydroxy-2,6-dimethyl-phen...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C29H36N6O8S2/c1-15-8-20(36)9-16(2)21(15)10-17(3)27(39)34-24-14-45-44-13-23(26(30)38)33-29(41)22(32-25(37)12-31-28(24)40)11-18-4-6-19(7-5-18)35(42)43/h4-9,17,22-24,36H,10-14H2,1-3H3,(H2,30,38)(H,31,40)(H,32,37)(H,33,41)(H,34,39)/t17-,22-,23+,24+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 92.8 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252860
((S)-N-((S)-1,6-diamino-1-oxohexan-2-yl)-1-((S)-5-g...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(-[#8])cc1-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C66H109N21O12/c1-8-38(4)54(62(98)84-48(23-16-28-77-66(73)74)63(99)87-29-17-24-51(87)61(97)81-45(55(68)91)20-12-13-25-67)86-58(94)47(22-15-27-76-65(71)72)82-57(93)46(21-14-26-75-64(69)70)83-59(95)49(30-37(2)3)85-60(96)50(34-42-18-10-9-11-19-42)80-53(90)36-78-52(89)35-79-56(92)41(7)33-44-39(5)31-43(88)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54,88H,8,12-17,20-30,33-36,67H2,1-7H3,(H2,68,91)(H,78,89)(H,79,92)(H,80,90)(H,81,97)(H,82,93)(H,83,95)(H,84,98)(H,85,96)(H,86,94)(H4,69,70,75)(H4,71,72,76)(H4,73,74,77)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 163 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DSLET from delta opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252855
((4S,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dimethyl-ph...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@@H]1CSSC[C@@H](NC(=O)[C@H](Cc2ccc(cc2)[N+]([O-])=O)NC(=O)CNC1=O)C(N)=O |r| Show InChI InChI=1S/C30H37N7O8S2/c1-15-8-19(26(31)39)9-16(2)21(15)10-17(3)28(41)36-24-14-47-46-13-23(27(32)40)35-30(43)22(34-25(38)12-33-29(24)42)11-18-4-6-20(7-5-18)37(44)45/h4-9,17,22-24H,10-14H2,1-3H3,(H2,31,39)(H2,32,40)(H,33,42)(H,34,38)(H,35,43)(H,36,41)/t17-,22-,23+,24+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 185 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252860
((S)-N-((S)-1,6-diamino-1-oxohexan-2-yl)-1-((S)-5-g...)Show SMILES [#6]-[#6]-[#6@H](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6@H](-[#6]-[#6](-[#6])-[#6])-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6]-[#7]-[#6](=O)-[#6@@H](-[#6])-[#6]-c1c(-[#6])cc(-[#8])cc1-[#6])-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-1-[#6]-[#6]-[#6]-[#6@H]-1-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#6]-[#7])-[#6](-[#7])=O |r| Show InChI InChI=1S/C66H109N21O12/c1-8-38(4)54(62(98)84-48(23-16-28-77-66(73)74)63(99)87-29-17-24-51(87)61(97)81-45(55(68)91)20-12-13-25-67)86-58(94)47(22-15-27-76-65(71)72)82-57(93)46(21-14-26-75-64(69)70)83-59(95)49(30-37(2)3)85-60(96)50(34-42-18-10-9-11-19-42)80-53(90)36-78-52(89)35-79-56(92)41(7)33-44-39(5)31-43(88)32-40(44)6/h9-11,18-19,31-32,37-38,41,45-51,54,88H,8,12-17,20-30,33-36,67H2,1-7H3,(H2,68,91)(H,78,89)(H,79,92)(H,80,90)(H,81,97)(H,82,93)(H,83,95)(H,84,98)(H,85,96)(H,86,94)(H4,69,70,75)(H4,71,72,76)(H4,73,74,77)/t38-,41-,45-,46-,47-,48-,49-,50-,51-,54-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 213 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(MOUSE) | BDBM50252862
((5S,8S,14R)-8-Benzyl-14-[(S)-2-[3-(4-hydroxy-2,6-d...)Show SMILES Cc1cc(O)cc(C)c1CCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H]1CCCCNC(=O)NC[C@H](NC(=O)[C@H](Cc2ccccc2)NC(=O)CNC1=O)C(O)=O |r| Show InChI InChI=1S/C41H51N7O10/c1-24-18-29(50)19-25(2)30(24)15-16-35(51)45-32(21-27-11-13-28(49)14-12-27)38(54)47-31-10-6-7-17-42-41(58)44-22-34(40(56)57)48-39(55)33(20-26-8-4-3-5-9-26)46-36(52)23-43-37(31)53/h3-5,8-9,11-14,18-19,31-34,49-50H,6-7,10,15-17,20-23H2,1-2H3,(H,43,53)(H,45,51)(H,46,52)(H,47,54)(H,48,55)(H,56,57)(H2,42,44,58)/t31-,32+,33+,34+/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 273 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against delta opioid receptor in mouse vas deference assessed as effect on DPDPE-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252858
((S)-2-({(4R,7S,13S)-7-(4-Fluoro-benzyl)-13-[(S)-3-...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C42H52FN5O8S2/c1-23-17-29(49)18-24(2)30(23)19-25(3)36(51)47-34-38(53)44-22-33(50)45-31(20-27-13-15-28(43)16-14-27)37(52)48-35(42(6,7)58-57-41(34,4)5)39(54)46-32(40(55)56)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35,49H,19-22H2,1-7H3,(H,44,53)(H,45,50)(H,46,54)(H,47,51)(H,48,52)(H,55,56)/t25-,31-,32-,34-,35+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 406 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252857
((S)-2-{[(4R,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dim...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C43H53FN6O8S2/c1-23-17-28(36(45)52)18-24(2)30(23)19-25(3)37(53)49-34-39(55)46-22-33(51)47-31(20-27-13-15-29(44)16-14-27)38(54)50-35(43(6,7)60-59-42(34,4)5)40(56)48-32(41(57)58)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35H,19-22H2,1-7H3,(H2,45,52)(H,46,55)(H,47,51)(H,48,56)(H,49,53)(H,50,54)(H,57,58)/t25-,31-,32-,34-,35+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.65E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Kappa-type opioid receptor
(Cavia porcellus (domestic guinea pig)) | BDBM50252858
((S)-2-({(4R,7S,13S)-7-(4-Fluoro-benzyl)-13-[(S)-3-...)Show SMILES C[C@@H](Cc1c(C)cc(O)cc1C)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C42H52FN5O8S2/c1-23-17-29(49)18-24(2)30(23)19-25(3)36(51)47-34-38(53)44-22-33(50)45-31(20-27-13-15-28(43)16-14-27)37(52)48-35(42(6,7)58-57-41(34,4)5)39(54)46-32(40(55)56)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35,49H,19-22H2,1-7H3,(H,44,53)(H,45,50)(H,46,54)(H,47,51)(H,48,52)(H,55,56)/t25-,31-,32-,34-,35+/m0/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]U69593 from kappa opioid receptor in guinea pig brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(Rattus norvegicus (rat)) | BDBM50252857
((S)-2-{[(4R,7S,13S)-13-[(S)-3-(4-Carbamoyl-2,6-dim...)Show SMILES C[C@@H](Cc1c(C)cc(cc1C)C(N)=O)C(=O)N[C@H]1C(=O)NCC(=O)N[C@@H](Cc2ccc(F)cc2)C(=O)N[C@H](C(=O)N[C@@H](Cc2ccccc2)C(O)=O)C(C)(C)SSC1(C)C |r| Show InChI InChI=1S/C43H53FN6O8S2/c1-23-17-28(36(45)52)18-24(2)30(23)19-25(3)37(53)49-34-39(55)46-22-33(51)47-31(20-27-13-15-29(44)16-14-27)38(54)50-35(43(6,7)60-59-42(34,4)5)40(56)48-32(41(57)58)21-26-11-9-8-10-12-26/h8-18,25,31-32,34-35H,19-22H2,1-7H3,(H2,45,52)(H,46,55)(H,47,51)(H,48,56)(H,49,53)(H,50,54)(H,57,58)/t25-,31-,32-,34-,35+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 5.85E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Displacement of [3H]DAMGO from mu opioid receptor in rat brain membrane |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Mu-type opioid receptor
(GUINEA PIG) | BDBM50252861
(CHEMBL507214 | H-D-Phe-c[Cys-Tyr-DTrp-Orn-Thr-Pen]...)Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CSSC1(C)C)NC(=O)[C@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O |r| Show InChI InChI=1S/C50H67N11O11S2/c1-26(62)39(42(53)65)59-49(72)41-50(3,4)74-73-25-38(58-43(66)33(52)21-28-11-6-5-7-12-28)47(70)56-36(22-29-16-18-31(64)19-17-29)45(68)57-37(23-30-24-54-34-14-9-8-13-32(30)34)46(69)55-35(15-10-20-51)44(67)60-40(27(2)63)48(71)61-41/h5-9,11-14,16-19,24,26-27,33,35-41,54,62-64H,10,15,20-23,25,51-52H2,1-4H3,(H2,53,65)(H,55,69)(H,56,70)(H,57,68)(H,58,66)(H,59,72)(H,60,67)(H,61,71)/t26-,27-,33-,35+,36+,37-,38+,39+,40+,41-/m1/s1 | PDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
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| Article
PubMed
| n/a | n/a | 2.80 | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against mu opioid receptor in guinea pig ileum assessed as effect on TAPP-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
Delta-type opioid receptor
(MOUSE) | BDBM50252861
(CHEMBL507214 | H-D-Phe-c[Cys-Tyr-DTrp-Orn-Thr-Pen]...)Show SMILES C[C@@H](O)[C@H](NC(=O)[C@H]1NC(=O)[C@@H](NC(=O)[C@H](CCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CSSC1(C)C)NC(=O)[C@H](N)Cc1ccccc1)[C@@H](C)O)C(N)=O |r| Show InChI InChI=1S/C50H67N11O11S2/c1-26(62)39(42(53)65)59-49(72)41-50(3,4)74-73-25-38(58-43(66)33(52)21-28-11-6-5-7-12-28)47(70)56-36(22-29-16-18-31(64)19-17-29)45(68)57-37(23-30-24-54-34-14-9-8-13-32(30)34)46(69)55-35(15-10-20-51)44(67)60-40(27(2)63)48(71)61-41/h5-9,11-14,16-19,24,26-27,33,35-41,54,62-64H,10,15,20-23,25,51-52H2,1-4H3,(H2,53,65)(H,55,69)(H,56,70)(H,57,68)(H,58,66)(H,59,72)(H,60,67)(H,61,71)/t26-,27-,33-,35+,36+,37-,38+,39+,40+,41-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.35E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
National University of Singapore
Curated by ChEMBL
| Assay Description
Antagonist activity against delta opioid receptor in mouse vas deference assessed as effect on DPDPE-induced response |
J Med Chem 51: 5866-70 (2008)
Article DOI: 10.1021/jm8004702
BindingDB Entry DOI: 10.7270/Q20G3K0M |
More data for this
Ligand-Target Pair | |
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