BDBM50310364 CHEMBL1077126::YESSOTOXIN

SMILES C[C@H]1CC[C@]2(C)O[C@]3(C)CC[C@@H]4O[C@@H]5C[C@@H]6O[C@@H]7C[C@H](OS([O-])(=O)=O)[C@@](C)(CCOS([O-])(=O)=O)O[C@H]7C[C@H]6O[C@H]5C[C@H]4O[C@H]3C[C@H]2O[C@H]2C[C@H]3O[C@H]4C[C@H]5O[C@@H](C(=C)C[C@@H]5O[C@]4(C)C[C@@H]3O[C@H]12)[C@](C)(O)\C=C\C(=C)CC=C

InChI Key InChIKey=CJHMURHVTGGIDY-NBMNKEGMSA-L

Data  4 Kd

  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 4 hits for monomerid = 50310364   

TargetcAMP-specific 3',5'-cyclic phosphodiesterase 4D(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50310364(CHEMBL1077126 | YESSOTOXIN)
Affinity DataKd:  1.00E+3nMAssay Description:Binding affinity to recombinant PDE4D by surface plasmon resonance assayMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRas-related protein Rap-1A(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50310364(CHEMBL1077126 | YESSOTOXIN)
Affinity DataKd:  4.00E+3nMAssay Description:Binding affinity to RAP1A in human RBC membrane by surface plasmon resonance analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetRas-related protein Rap-1A(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50310364(CHEMBL1077126 | YESSOTOXIN)
Affinity DataKd:  4.00E+3nMAssay Description:Binding affinity to RAP1A in human RBC membrane by western blot analysisMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetGlycophorin-A(Homo sapiens (Human))
Osaka University

Curated by ChEMBL
LigandPNGBDBM50310364(CHEMBL1077126 | YESSOTOXIN)
Affinity DataKd:  1.20E+5nMAssay Description:Binding affinity to transmembrane alpha-helix of glycophorin A by surface plasmon resonance methodMore data for this Ligand-Target Pair
In DepthDetails ArticlePubMed