BDBM50077138 CHEMBL3416753

SMILES [O-]C(=O)C(F)(F)F.CCN1\C(=C/C=C/C=C/C2=[N+](CC)c3cc(ccc3C2(C)C)S([O-])(=O)=O)C(C)(CCCC(=O)NCCOCCOCCOCCOCc2nnc(N3CC(C3)Oc3ccc(F)cc3Cl)n2-c2ccc(OC)[nH+]c2)c2cc(ccc12)S(O)(=O)=O

InChI Key InChIKey=QKURLEPQJVUPKZ-UHFFFAOYSA-O

Data  4 Kd  1 Koff  1 Kon

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50077138   

TargetVasopressin V1a receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKd: >1.00E+3nMAssay Description:Binding affinity to V1aR (unknown origin) expressed in HEK293 cells by TR-FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetOxytocin receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKd:  1.60nMAssay Description:Binding affinity to SNAP-tagged oxytocin receptor (unknown origin) expressed in HEK293 cells by TR-FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetOxytocin receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKon:  0.000182M-1s-1Assay Description:Binding affinity to SNAP-tagged oxytocin receptor (unknown origin) expressed in HEK293 cells assessed as dissociation constant after 5 to 120 mins by...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetVasopressin V2 receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKd:  509nMAssay Description:Binding affinity to V2R (unknown origin) expressed in HEK293 cells by TR-FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetOxytocin receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKoff:  6.72E+4s-1Assay Description:Binding affinity to SNAP-tagged oxytocin receptor (unknown origin) expressed in HEK293 cells assessed as association constant after 5 to 120 mins by ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

TargetVasopressin V1b receptor(Human)
University of Strasburg

Curated by ChEMBL
LigandPNGBDBM50077138(CHEMBL3416753)
Affinity DataKd: >1.00E+3nMAssay Description:Binding affinity to V1bR (unknown origin) expressed in HEK293 cells by TR-FRET assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed