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PubMed code 16997560

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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
Lactoylglutathione lyase


(Saccharomyces cerevisiae)
BDBM50092826
PNG
((2S)-2-amino-5-{[(1R)-1-[({[(4-bromophenyl)(hydrox...)
Show SMILES N[C@@H](CCC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C17H21BrN4O8S/c18-9-1-3-10(4-2-9)22(30)17(29)31-8-12(15(26)20-7-14(24)25)21-13(23)6-5-11(19)16(27)28/h1-4,11-12,30H,5-8,19H2,(H,20,26)(H,21,23)(H,24,25)(H,27,28)/t11-,12-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
KEGG
MMDB
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.20E+3n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of yeast glyoxalase1


Bioorg Med Chem Lett 16: 6039-42 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.121
BindingDB Entry DOI: 10.7270/Q2V987QT
More data for this
Ligand-Target Pair
Lactoylglutathione lyase


(Saccharomyces cerevisiae)
BDBM50195360
PNG
((2S)-2-amino-3-[({[(1R)-1-[({[(4-bromophenyl)(hydr...)
Show SMILES N[C@@H](CNC(=O)N[C@@H](CSC(=O)N(O)c1ccc(Br)cc1)C(=O)NCC(O)=O)C(O)=O
Show InChI InChI=1S/C16H20BrN5O8S/c17-8-1-3-9(4-2-8)22(30)16(29)31-7-11(13(25)19-6-12(23)24)21-15(28)20-5-10(18)14(26)27/h1-4,10-11,30H,5-7,18H2,(H,19,25)(H,23,24)(H,26,27)(H2,20,21,28)/t10-,11-/m0/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
2.19E+3n/an/an/an/an/an/an/an/a



University of Minnesota

Curated by ChEMBL


Assay Description
Inhibition of yeast glyoxalase1


Bioorg Med Chem Lett 16: 6039-42 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.121
BindingDB Entry DOI: 10.7270/Q2V987QT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%