BDBM50221424 (S)-2-amino-N-(3-(5-benzyl-6-methyl-3-oxo-3,4-dihydropyrazin-2-yl)propyl)-3-(4-hydroxy-2,6-dimethylphenyl)propanamide::CHEMBL236461
SMILES: Cc1cc(O)cc(C)c1C[C@H](N)C(=O)NCCCc1nc(C)c(Cc2ccccc2)[nH]c1=O
InChI Key: InChIKey=JEGWUGKGNRTWAQ-QFIPXVFZSA-N
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)) | BDBM50221424 ((S)-2-amino-N-(3-(5-benzyl-6-methyl-3-oxo-3,4-dihy...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kobe Gakuin University Curated by ChEMBL | Assay Description Displacement of [3H]DAMGO from human mu opioid receptor | Bioorg Med Chem Lett 17: 5768-71 (2007) Article DOI: 10.1016/j.bmcl.2007.08.058 BindingDB Entry DOI: 10.7270/Q2N29WPB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (Homo sapiens (Human)) | BDBM50221424 ((S)-2-amino-N-(3-(5-benzyl-6-methyl-3-oxo-3,4-dihy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 60 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kobe Gakuin University Curated by ChEMBL | Assay Description Displacement of [3H]deltorphin 2 from delta opioid receptor | Bioorg Med Chem Lett 17: 5768-71 (2007) Article DOI: 10.1016/j.bmcl.2007.08.058 BindingDB Entry DOI: 10.7270/Q2N29WPB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (GUINEA PIG) | BDBM50221424 ((S)-2-amino-N-(3-(5-benzyl-6-methyl-3-oxo-3,4-dihy...) | UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Kobe Gakuin University Curated by ChEMBL | Assay Description Agonist activity at mu opioid receptor in guinea pig ileum assessed as inhibition of electrically-stimulated muscle contraction | Bioorg Med Chem Lett 17: 5768-71 (2007) Article DOI: 10.1016/j.bmcl.2007.08.058 BindingDB Entry DOI: 10.7270/Q2N29WPB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (MOUSE) | BDBM50221424 ((S)-2-amino-N-(3-(5-benzyl-6-methyl-3-oxo-3,4-dihy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Kobe Gakuin University Curated by ChEMBL | Assay Description Agonist activity at delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction | Bioorg Med Chem Lett 17: 5768-71 (2007) Article DOI: 10.1016/j.bmcl.2007.08.058 BindingDB Entry DOI: 10.7270/Q2N29WPB | |||||||||||
More data for this Ligand-Target Pair |