BDBM10515 5-(1,2-dithiolan-3-yl)pentanoic acid::CHEMBL33864::D,L-Lipoic acid::D,L-Thioctic acid::cid_864::lipoic acid (LA)

SMILES OC(=O)CCCCC1CCSS1

InChI Key InChIKey=AGBQKNBQESQNJD-UHFFFAOYSA-N

Data  1 KI  5 IC50

PDB links: 10 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 10515   

TargetAcetylcholinesterase(Homo sapiens (Human))
University of Bologna

LigandBDBM10515(5-(1,2-dithiolan-3-yl)pentanoic acid | CHEMBL33864...)Copy SMILESCopy InChI

Affinity DataIC50: >1.00E+6nMpH: 8.0 T: 2°CAssay Description:The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at...More data for this Ligand-Target Pair

Target InfoPDBMMDBNCI pathwayReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoPurchaseChEBI
CHEMBLDrugBankMCE
KEGGPC cidPC sidPDBPatentsSimilars

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