BindingDB BDBM50001683 13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triaza-cyclotetradecane-4-carboxylic acid::7-Benzyl-10-{[3-(4-hydroxy-phenyl)-pyrrolidine-2-carbonyl]-amino}-3,3-dimethyl-6,9-dioxo-1,2-dithia-5,8-diaza-cycloundecane-4-carboxylic acid::CHEMBL294616::DPDPE

BDBM50001683 13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7-benzyl-3,3,14,14-tetramethyl-6,9,12-trioxo-1,2-dithia-5,8,11-triaza-cyclotetradecane-4-carboxylic acid::7-Benzyl-10-{[3-(4-hydroxy-phenyl)-pyrrolidine-2-carbonyl]-amino}-3,3-dimethyl-6,9-dioxo-1,2-dithia-5,8-diaza-cycloundecane-4-carboxylic acid::CHEMBL294616::DPDPE

SMILES CC1(C)SSC(C)(C)[C@@H](NC(=O)[C@@H](N)Cc2ccc(O)cc2)C(=O)NCC(=O)N[C@H](Cc2ccccc2)C(=O)N[C@H]1C(O)=O

InChI Key InChIKey=MCMMCRYPQBNCPH-DVKRWUGUSA-N

Data 46 KI 76 IC50 2 Kd 20 EC50

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 20 hits for monomerid = 50001683

Mu-type opioid receptor(GUINEA PIG)
University Of Michigan

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 7.30E+3nMAssay Description:Effective concentration was measured towards mu opioid receptor using guinea pig ileum (GPI,mu) bioassay in vitroMore data for this Ligand-Target Pair

PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(MOUSE)
Kitasato University

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 4.10nMAssay Description:Effective concentration was measured towards delta opioid receptor using mouse vas deferens(MVD, delta) bioassay in vitroMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 1.60nMAssay Description:Agonist activity at human delta opioid receptor expressed in mouse HN9.10 cells by [35S]GTPgammaS binding assayMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Mu-type opioid receptor(Homo sapiens (Human))
University Of Bath

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: >1.00E+4nMAssay Description:Stimulation of [35S]GTP-gamma-S, binding to recombinant human Opioid receptor mu 1 expressed in CHO cellsMore data for this Ligand-Target Pair

PDB NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Kappa-type opioid receptor(Homo sapiens (Human))
Harvard Medical School

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: >1.00E+4nMAssay Description:Stimulation of U-69,593 binding at human recombinant Opioid receptor kappa 1 transfected into CHO cells.More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 1.30nMAssay Description:Stimulation of [35S]GTP-gamma-S, binding at human recombinant Opioid receptor delta 1 transfected into CHO cells.More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 1.60nMAssay Description:Inhibition of [35S]GTP-gamma-S binding to human delta opioid receptor expressed in CHO cellsMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Mu-type opioid receptor(GUINEA PIG)
University Of Michigan

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 7.30E+3nMAssay Description:In vitro bioassay data to determine the effective concentration required for antagonistic activity against Opioid receptor mu 1 in functional assay,G...More data for this Ligand-Target Pair

PDB
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(MOUSE)
Kitasato University

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 4.10nMAssay Description:In vitro bioassay data to determine the effective concentration required for antagonistic activity against Opioid receptor delta 1 in functional assa...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 15nMAssay Description:Activity at delta opioid receptor expressed in HEK293 cells assessed as stimulation of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 0.140nMAssay Description:Agonist activity at human DOR expressed in HEK293 cell membrane assessed as inhibition of forskolin-induced cAMP accumulation by by liquid scintillat...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 3nMAssay Description:Antagonist activity at human recombinant delta opioid receptor expressed in CHO cells coexpressing alphaqi5 assessed as inhibition of DPDPE-induced i...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 1.60nMAssay Description:Agonist activity at human delta opioid receptor expressed in CHO cells assessed as stimulation of [35S]GTPgammaS bindingMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 1.60nMAssay Description:Agonist activity at human delta opioid receptor expressed in mouse HN9.10 cell membrane by [35S]GTPgamma binding assayMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 0.557nMAssay Description:Agonist activity at Myc-tagged delta-type opioid receptor (unknown origin) expressed in HEK293 cells assessed as inhibition of forskolin-stimulated c...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 9.30nMAssay Description:Agonist activity at human DOR expressed in CHO cells by [35S]GTPgammaS binding assayMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 0.800nMAssay Description:Agonist activity at delta opioid receptor (unknown origin) expressed in CHO cells assessed as change in cell morphology measured over 30 mins by labe...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 16nMAssay Description:Agonist activity at human recombinant delta opioid receptor expressed in CHO cells co-expressing Galphaq66Di5 assessed as stimulation of calcium rele...More data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(Homo sapiens (Human))
University Of Arizona

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 6.30nMAssay Description:Agonist activity at human delta opioid receptor transfected in CHOK1 cells after 60 mins by [35S]GTPgammaS binding assayMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Delta-type opioid receptor(MOUSE)
Kitasato University

Curated by ChEMBL

PNG

BDBM50001683(13-[2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-7...)

EC50: 2.10nMAssay Description:Agonist activity at mouse cloned delta opioid receptor expressed in CHO cells after 60 mins by [35S]GTPgammaS binding assayMore data for this Ligand-Target Pair

PDB Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD GoogleScholar

CHEMBL PC cid PC sid Similars

Details Article PubMed

Filter my 144 hits

Targets 6▿
- Delta-type opioid receptor 77
- Mu-type opioid receptor 49
- Kappa-type opioid receptor 13
- ATP-dependent translocase ABCB1 3
- Delta-type opioid receptor/Kappa-type opioid receptor/Mu-type opioid receptor/Sigma non-opioid intracellular receptor 1 1
- Nociceptin receptor 1
Publications 50▿
- J Med Chem 46: 1563-6 (2003) 6
- J Med Chem 35: 2384-91 (1992) 5
- J Med Chem 52: 5164-75 (2010) 5
- J Med Chem 35: 1521-5 (1992) 5
- J Med Chem 45: 3746-54 (2002) 5
- J Med Chem 37: 146-50 (1994) 4
- J Med Chem 37: 1572-7 (1994) 4
- J Med Chem 40: 3957-62 (1998) 4
- J Med Chem 53: 5491-501 (2010) 4
- J Med Chem 34: 1823-30 (1991) 4
- J Med Chem 37: 1746-57 (1994) 4
- J Med Chem 34: 1656-61 (1991) 4
- Bioorg Med Chem 18: 4975-82 (2010) 4
- J Med Chem 46: 4215-31 (2003) 4
- J Med Chem 54: 6531-7 (2011) 4
- J Med Chem 38: 570-9 (1995) 3
- J Med Chem 37: 4270-7 (1995) 3
- J Med Chem 37: 2856-64 (1994) 3
- J Med Chem 35: 1535-41 (1992) 3
- J Med Chem 31: 374-83 (1988) 3
- J Med Chem 35: 4498-500 (1992) 3
- J Med Chem 46: 1716-25 (2003) 3
- J Med Chem 41: 2631-5 (1998) 3
- Bioorg Med Chem Lett 24: 4895-8 (2014) 2
- J Med Chem 36: 3182-7 (1993) 2
- Bioorg Med Chem Lett 21: 4001-4 (2011) 2
- J Med Chem 39: 4120-4 (1996) 2
- J Med Chem 40: 695-704 (1997) 2
- J Med Chem 35: 684-7 (1992) 2
- J Med Chem 47: 1400-12 (2004) 2
- J Med Chem 37: 2125-8 (1994) 2
- J Med Chem 31: 1891-7 (1988) 2
- J Med Chem 32: 638-43 (1989) 2
- J Med Chem 41: 4767-76 (1998) 2
- J Med Chem 38: 1523-37 (1995) 2
- J Med Chem 39: 2081-6 (1996) 2
- J Med Chem 33: 249-53 (1990) 2
- Bioorg Med Chem Lett 8: 2027-32 (1999) 2
- Eur J Med Chem 92: 270-81 (2015) 1
- J Med Chem 35: 4325-9 (1992) 1
- J Med Chem 49: 1773-80 (2006) 1
- J Med Chem 54: 7848-59 (2011) 1
- Bioorg Med Chem Lett 9: 3053-6 (1999) 1
- Bioorg Med Chem 22: 4694-703 (2014) 1
- J Nat Prod 70: 866-8 (2007) 1
- J Med Chem 54: 382-6 (2011) 1
- Bioorg Med Chem 17: 6671-81 (2009) 1
- J Med Chem 56: 3102-14 (2013) 1
- J Med Chem 55: 10292-6 (2012) 1
- J Med Chem 51: 6334-47 (2008) 1
- ...
Institutions 30▿
- University Of Arizona 42
- University Of Bath 10
- University Of Washington 9
- National Institute Of Diabetes And Digestive And Kidney Diseases 8
- University Of Michigan 6
- Harvard Medical School 5
- University Of California 5
- University of Arizona 5
- University Of Ferrara 4
- University Of Catania 4
- University Of Paris 3
- University Of California San Diego 3
- F. Hoffmann-La Roche 3
- Southern Research Institute 2
- The University Of Arizona 2
- Kitasato University 2
- Memorial Sloan-Kettering Cancer Center 2
- Institute For Bioorganic Research 2
- Clinical Research Institute Of Montreal 2
- Ua 498 Cnrs 2
- Searle Research And Development 2
- University Of Bologna 1
- Lanzhou University 1
- National Health Research Institutes 1
- University Of Minnesota 1
- Research Triangle Institute 1
- Vrije Universiteit Brussel 1
- Zhejiang University 1
- Griffith University 1
- Human Biomolecular Research Institute 1
- ...
Affinity: 0.14 to 5.0E+4 nM▿
- Ki 46
- IC50 76
- Kd 2
- EC50 20
- Affinity ≤ nM
Xtal structures: 0
Docked structures: 0
Catalog Cmpds: 0