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BDBM106941 US8592468, EbSe8

SMILES: Cc1cc(Cl)ccc1-n1[se]c2ccccc2c1=O

InChI Key: InChIKey=ZWJGMJZWOBLCCN-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 106941   
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
Thioredoxin reductase (TrxR)


(Escherichia coli (strain K12))
BDBM106941
PNG
(US8592468, EbSe8)
Show SMILES Cc1cc(Cl)ccc1-n1[se]c2ccccc2c1=O
Show InChI InChI=1S/C14H10ClNOSe/c1-9-8-10(15)6-7-12(9)16-14(17)11-4-2-3-5-13(11)18-16/h2-8H,1H3
PDB
MMDB

KEGG

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PC cid
PC sid
UniChem

Similars

US Patent
250n/a 6.00E+3n/an/an/an/an/an/a



Thioredoxin Systems AB

US Patent


Assay Description
All the benzisoselenazol-3(2H)-one and bisbenzisoselenazol-3(2H)-one derivatives were tested as potential E. coli TrxR inhibitors by standard DTNB ...


US Patent US8592468 (2013)


BindingDB Entry DOI: 10.7270/Q29P3081
More data for this
Ligand-Target Pair