BDBM50273933 (4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethyl-1H-4,11b-methanobenzofuro[3,2-d]azocine-10-ol::CHEMBL515681
SMILES: Oc1ccc2O[C@@H]3CC[C@H]4C[C@@]3(CCN4CCc3ccccc3)c2c1
InChI Key: InChIKey=NEVNFUOTQDJGBE-RRNUJPESSA-N
Data: 6 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Kappa-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 78 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human recombinant kappa opioid receptor expressed in CHO cells | J Med Chem 51: 7866-81 (2008) Article DOI: 10.1021/jm800913d BindingDB Entry DOI: 10.7270/Q2639PM8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Kappa-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 102 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human kappa opioid receptor expressed in CHO cells coexpressing human recombinant KOP after 2 hrs by liquid scintilla... | Bioorg Med Chem 19: 4330-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.035 BindingDB Entry DOI: 10.7270/Q2902452 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 352 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human mu opioid receptor expressed in CHO cells coexpressing human recombinant MOR after 2 hrs by liquid scintillatio... | Bioorg Med Chem 19: 4330-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.035 BindingDB Entry DOI: 10.7270/Q2902452 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 740 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human recombinant mu opioid receptor expressed in CHO cells | J Med Chem 51: 7866-81 (2008) Article DOI: 10.1021/jm800913d BindingDB Entry DOI: 10.7270/Q2639PM8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 4.76E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human recombinant delta opioid receptor expressed in CHO cells | J Med Chem 51: 7866-81 (2008) Article DOI: 10.1021/jm800913d BindingDB Entry DOI: 10.7270/Q2639PM8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (Homo sapiens (Human)) | BDBM50273933 ((4R*,6aS*,11bR*)-2,3,4,5,6,6a-Hexahydro-3-phenethy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
National Institute on Drug Abuse and the National Institute on Alcohol Abuse and Alcoholism Curated by ChEMBL | Assay Description Displacement of [125I]IOXY from human delta opioid receptor expressed in CHO cells coexpressing human recombinant DOR after 2 hrs by liquid scintilla... | Bioorg Med Chem 19: 4330-7 (2011) Article DOI: 10.1016/j.bmc.2011.05.035 BindingDB Entry DOI: 10.7270/Q2902452 | |||||||||||
More data for this Ligand-Target Pair |