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BDBM50426069 CHEMBL2315305

SMILES: CC(C)(C)SSc1nc2ccccc2[nH]1

InChI Key: InChIKey=JUGXHSUVCKNTAC-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50426069   
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


(Homo sapiens (Human))
BDBM50426069
PNG
(CHEMBL2315305)
Show SMILES CC(C)(C)SSc1nc2ccccc2[nH]1
Show InChI InChI=1S/C11H14N2S2/c1-11(2,3)15-14-10-12-8-6-4-5-7-9(8)13-10/h4-7H,1-3H3,(H,12,13)
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 7.31E+3n/an/an/an/an/an/a



Stanford University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant thioredoxin-mediated TG2 activation expressed in T84 cells assessed as blockade of 5-biotinamidopentylamine incorpora...


J Med Chem 56: 1301-10 (2013)


Article DOI: 10.1021/jm301775s
BindingDB Entry DOI: 10.7270/Q2HQ4181
More data for this
Ligand-Target Pair