BDBM50487756 CHEBI:17965::Isoorientin

SMILES c1cc(c(cc1C2=CC(=O)c3c(cc(c(c3O)[C@H]4[C@@H]([C@H]([C@@H]([C@H](O4)CO)O)O)O)O)O2)O)O

InChI Key InChIKey=ODBRNZZJSYPIDI-UHFFFAOYSA-N

Data  2 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50487756   

TargetAldo-keto reductase family 1 member B1(Human)TBA

LigandBDBM50487756(CHEBI:17965 | Isoorientin)Copy SMILESCopy InChI

Affinity DataIC50: 1.91E+3nMAssay Description:Inhibition of aldose reductase (unknown origin)More data for this Ligand-Target Pair

Target InfoPDB
UniProtKB/SwissProt
GoogleScholar

Ligand InfoPurchaseKEGGPC cidPC sidPDBSimilars

In Depth
Date in BDB:
8/30/2020
Entry Details Article
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TargetGlycogen synthase kinase-3 beta(Human)
West China Hospital

Curated by ChEMBL

LigandBDBM50487756(CHEBI:17965 | Isoorientin)Copy SMILESCopy InChI

Affinity DataIC50: 1.85E+5nMAssay Description:Inhibition of GSK-3beta (unknown origin) using peptide YRRAAVPPSPSLSRHSSPHQ(pS)EDEEE as substrate incubated for 5 to 60 mins by ADP-Glo kinase assayMore data for this Ligand-Target Pair

Target InfoPDBKEGG
UniProtKB/SwissProtUniProtKB/TrEMBL
GoogleScholar

Ligand InfoPurchaseKEGGPC cidPC sidPDBSimilars

In Depth
Date in BDB:
6/21/2023
Entry Details
Copy BDB DOIPubMed
Copy reaction URL