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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transketolase' and Ligand = 'BDBM50373735'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transketolase


(Homo sapiens (Human))
BDBM50373735
PNG
(CHEMBL255603)
Show SMILES Cc1c(CCO)sc[n+]1Cc1ccc(N)nc1
Show InChI InChI=1S/C12H16N3OS/c1-9-11(4-5-16)17-8-15(9)7-10-2-3-12(13)14-6-10/h2-3,6,8,16H,4-5,7H2,1H3,(H2,13,14)/q+1
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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 1.60E+3n/an/an/an/a



Array BioPharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of human transketolase in HCT116 cells


Bioorg Med Chem Lett 18: 2206-10 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.101
BindingDB Entry DOI: 10.7270/Q26D5TVN
More data for this
Ligand-Target Pair
Transketolase


(Homo sapiens (Human))
BDBM50373735
PNG
(CHEMBL255603)
Show SMILES Cc1c(CCO)sc[n+]1Cc1ccc(N)nc1
Show InChI InChI=1S/C12H16N3OS/c1-9-11(4-5-16)17-8-15(9)7-10-2-3-12(13)14-6-10/h2-3,6,8,16H,4-5,7H2,1H3,(H2,13,14)/q+1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 7n/an/an/an/an/a



Array BioPharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of transketolase by TPPK/apo-TK coupled assay


Bioorg Med Chem Lett 18: 2206-10 (2008)


Article DOI: 10.1016/j.bmcl.2007.11.101
BindingDB Entry DOI: 10.7270/Q26D5TVN
More data for this
Ligand-Target Pair