BDBM50611973 CHEMBL5282692

SMILES [H][C@@]1(CC[C@@]2([H])[C@]3([H])CC[C@]4([H])CC[C@@]([H])(C[C@]4(C)[C@@]3([H])CC[C@]12C)O[C@@H]1O[C@H](COS(O)(=O)=O)[C@@]([H])(O[C@H]2O[C@H](COS(O)(=O)=O)[C@@H](O[C@@]3([H])O[C@H](COS(O)(=O)=O)[C@@]([H])(O[C@H]4O[C@H](COS(O)(=O)=O)[C@@H](OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]4OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]3OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]2OS(O)(=O)=O)[C@H](OS(O)(=O)=O)[C@H]1OS(O)(=O)=O)[C@H](C)CCCC(C)C

InChI Key InChIKey=CYTCAGXMNYCCEF-UHFFFAOYSA-N

Data  1 IC50

  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 1 hit for monomerid = 50611973   

TargetHeparanase(Human)
Guangzhou University of Chinese Medicine

Curated by ChEMBL
LigandPNGBDBM50611973(CHEMBL5282692)
Affinity DataIC50: 12nMAssay Description:Inhibition of HPSE (unknown origin) using fondaparinux as substrate incubated for 18 hrs by fluorescence plate reader analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/21/2024
Entry Details
PubMed