BDBM50380759 CHEMBL2017869

SMILES CS(=O)(=O)N1CCC(CC1)Oc1ccc(CC(=O)N2CCC(CC2)N2C(=O)CCc3ccccc23)c(OCCF)c1

InChI Key InChIKey=SYRRIFTXJYXCIX-UHFFFAOYSA-N

Data  8 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50380759   

TargetOxytocin receptor(Microtus ochrogaster)
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  2.90nMAssay Description:Displacement of [125I]-OVTA from prairie vole Oxytocin receptor after 72 hrsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V1a receptor(Microtus ochrogaster)
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  9.40nMAssay Description:Displacement of [125I]-LVA from prairie vole vasopressin V1A receptor after 72 hrsMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOxytocin receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  16nMAssay Description:Displacement of [3H]Oxytocin from human OXTR expressed in CHO cell membranes after 90 mins by liquid scintillation counting methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOxytocin receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  16nMAssay Description:Binding affinity to human OTR by competitive binding assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetOxytocin receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  16nMAssay Description:Displacement of [3H]oxytocin from human oxytocin receptor after 1.5 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V1b receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi: >1.00E+3nMAssay Description:Displacement of [3H]-AVP from human V1b receptor after 1.5 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V2 receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  1.80E+3nMAssay Description:Displacement of [3H]-AVP from human vasopressin V2 receptor after 1.5 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetVasopressin V1a receptor(Homo sapiens (Human))
Emory University

Curated by ChEMBL
LigandPNGBDBM50380759(CHEMBL2017869)
Affinity DataKi:  8.70E+3nMAssay Description:Displacement of [3H]-AVP from human V1A receptor after 1.5 hrs by liquid scintillation countingMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed