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BDBM522147 US11161815, Example 3

SMILES: CCCCCCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O

InChI Key:

Data: 2 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 2 hits for monomerid = 522147   
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
Glutathione reductase, mitochondrial


(Homo sapiens (Human))
BDBM522147
PNG
(US11161815, Example 3)
Show SMILES CCCCCCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a>1.00E+5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Thioredoxin reductase 1, cytoplasmic


(Homo sapiens (Human))
BDBM522147
PNG
(US11161815, Example 3)
Show SMILES CCCCCCS(=O)(=O)c1nc(OC)ccc1[N+]([O-])=O
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 489n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair