BDBM50405568 CHEMBL5273557

SMILES c1cc(ccc1CCc2cn3c(n2)[C@@H]([C@H]([C@@H]([C@H]3C(=O)O)O)O)O)C(F)(F)F

InChI Key InChIKey=LZSIPXVQPVTVNE-UHFFFAOYSA-N

Data  3 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50405568   

TargetHeparanase(Human)
Taisho Pharmaceutical Co.

Curated by ChEMBL
LigandPNGBDBM50405568(CHEMBL5273557)
Affinity DataIC50: 3.41E+3nMAssay Description:Inhibition of Heparanase-1 (unknown origin) by HTRF methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMedPDB3D3D Structure (crystal)
TargetBeta-glucuronidase(Human)
Taisho Pharmaceutical Co.

Curated by ChEMBL
LigandPNGBDBM50405568(CHEMBL5273557)
Affinity DataIC50: 9.80nMAssay Description:Inhibition of human beta-glucuronidaseMore data for this Ligand-Target Pair
In Depth
Date in BDB:
4/18/2024
Entry Details
PubMed
TargetHeparanase(Human)
Taisho Pharmaceutical Co.

Curated by ChEMBL
LigandPNGBDBM50405568(CHEMBL5273557)
Affinity DataIC50: 3.41E+3nMAssay Description:Inhibition of recombinant human HPSE1 using biotinylated heparan sulfate-Eu cryptate as substrate pre-incubated for 10 mins followed by substrate add...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMedPDB3D3D Structure (crystal)