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BDBM16435 5-(1,2-dithiolan-3-yl)pentanamide::5-(dithiolan-3-yl)pentanamide::D,L-Lipoamide::Thioctamide

SMILES: NC(=O)CCCCC1CCSS1

InChI Key: InChIKey=FCCDDURTIIUXBY-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 16435   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aldose reductase (AR)


(Homo sapiens (Human))
BDBM16435
PNG
(5-(1,2-dithiolan-3-yl)pentanamide | 5-(dithiolan-3...)
Show SMILES NC(=O)CCCCC1CCSS1
Show InChI InChI=1S/C8H15NOS2/c9-8(10)4-2-1-3-7-5-6-11-12-7/h7H,1-6H2,(H2,9,10)
PDB

UniProtKB/SwissProt

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KEGG
PC cid
PC sid
UniChem

Patents

Article
PubMed
8.60E+4 -5.54n/an/an/an/an/a7.025



Medical College of Wiscosin



Assay Description
The production of NADPH from NADP+ and benzyl alcohol and xylitol was monitored by an increase in NADPH fluorescence (ex: 340 nm; em: 460 nm) using a...


Bioorg Chem 34: 424-44 (2006)


Article DOI: 10.1016/j.bioorg.2006.09.004
BindingDB Entry DOI: 10.7270/Q2SN076W
More data for this
Ligand-Target Pair