Found 3 hits for monomerid = 50108959 Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Mu-type opioid receptor
(Homo sapiens (Human)) | BDBM50108959
(CHEMBL3597071)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C82H133N19O25/c1-42(2)33-54(68(87)112)95-77(121)58(41-125-80-67(111)66(110)65(109)60(40-102)126-80)98-73(117)52(22-16-18-31-84)94-75(119)55(34-43(3)4)96-70(114)46(8)91-72(116)51(21-15-17-30-83)93-74(118)53(27-28-64(107)108)99-81(124)82(9,10)100-78(122)56(35-44(5)6)97-76(120)57(38-61(86)104)92-62(105)29-32-88-79(123)59(37-47-19-13-12-14-20-47)101(11)63(106)39-89-69(113)45(7)90-71(115)50(85)36-48-23-25-49(103)26-24-48/h12-14,19-20,23-26,42-46,50-60,65-67,80,102-103,109-111H,15-18,21-22,27-41,83-85H2,1-11H3,(H2,86,104)(H2,87,112)(H,88,123)(H,89,113)(H,90,115)(H,91,116)(H,92,105)(H,93,118)(H,94,119)(H,95,121)(H,96,114)(H,97,120)(H,98,117)(H,99,124)(H,100,122)(H,107,108)/t45-,46+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60-,65-,66+,67-,80-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| PubMed
| 4.80 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Arizona
Curated by ChEMBL
| Assay Description Displacement of [3H]-DAMGO from human mu opioid receptor expressed in CHO cells after 60 mins by scintillation counting analysis |
J Med Chem 58: 5728-41 (2015)
BindingDB Entry DOI: 10.7270/Q2KH0Q33 |
More data for this Ligand-Target Pair | |
Kappa-type opioid receptor
(Homo sapiens (Human)) | BDBM50108959
(CHEMBL3597071)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C82H133N19O25/c1-42(2)33-54(68(87)112)95-77(121)58(41-125-80-67(111)66(110)65(109)60(40-102)126-80)98-73(117)52(22-16-18-31-84)94-75(119)55(34-43(3)4)96-70(114)46(8)91-72(116)51(21-15-17-30-83)93-74(118)53(27-28-64(107)108)99-81(124)82(9,10)100-78(122)56(35-44(5)6)97-76(120)57(38-61(86)104)92-62(105)29-32-88-79(123)59(37-47-19-13-12-14-20-47)101(11)63(106)39-89-69(113)45(7)90-71(115)50(85)36-48-23-25-49(103)26-24-48/h12-14,19-20,23-26,42-46,50-60,65-67,80,102-103,109-111H,15-18,21-22,27-41,83-85H2,1-11H3,(H2,86,104)(H2,87,112)(H,88,123)(H,89,113)(H,90,115)(H,91,116)(H,92,105)(H,93,118)(H,94,119)(H,95,121)(H,96,114)(H,97,120)(H,98,117)(H,99,124)(H,100,122)(H,107,108)/t45-,46+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60-,65-,66+,67-,80-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| PubMed
| 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Arizona
Curated by ChEMBL
| Assay Description Displacement of [3H]-U69593 from human kappa opioid receptor expressed in CHO cells after 60 mins by scintillation counting analysis |
J Med Chem 58: 5728-41 (2015)
BindingDB Entry DOI: 10.7270/Q2KH0Q33 |
More data for this Ligand-Target Pair | |
Delta-type opioid receptor
(Homo sapiens (Human)) | BDBM50108959
(CHEMBL3597071)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)CCNC(=O)[C@H](Cc1ccccc1)N(C)C(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(N)=O |r| Show InChI InChI=1S/C82H133N19O25/c1-42(2)33-54(68(87)112)95-77(121)58(41-125-80-67(111)66(110)65(109)60(40-102)126-80)98-73(117)52(22-16-18-31-84)94-75(119)55(34-43(3)4)96-70(114)46(8)91-72(116)51(21-15-17-30-83)93-74(118)53(27-28-64(107)108)99-81(124)82(9,10)100-78(122)56(35-44(5)6)97-76(120)57(38-61(86)104)92-62(105)29-32-88-79(123)59(37-47-19-13-12-14-20-47)101(11)63(106)39-89-69(113)45(7)90-71(115)50(85)36-48-23-25-49(103)26-24-48/h12-14,19-20,23-26,42-46,50-60,65-67,80,102-103,109-111H,15-18,21-22,27-41,83-85H2,1-11H3,(H2,86,104)(H2,87,112)(H,88,123)(H,89,113)(H,90,115)(H,91,116)(H,92,105)(H,93,118)(H,94,119)(H,95,121)(H,96,114)(H,97,120)(H,98,117)(H,99,124)(H,100,122)(H,107,108)/t45-,46+,50+,51+,52+,53+,54+,55+,56+,57+,58+,59+,60-,65-,66+,67-,80-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL KEGG PC cid PC sid UniChem
Similars
| PubMed
| 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Arizona
Curated by ChEMBL
| Assay Description Displacement of [3H]-naltrindole from human delta opioid receptor expressed in CHO cells after 3 hrs by scintillation counting analysis |
J Med Chem 58: 5728-41 (2015)
BindingDB Entry DOI: 10.7270/Q2KH0Q33 |
More data for this Ligand-Target Pair | |