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PubMed code 23895568

Compile data set for download or QSAR
Found 4 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
Glyceraldehyde-3-phosphate dehydrogenase


(Oryctolagus cuniculus)
BDBM50439262
PNG
(CHEMBL2419244)
Show SMILES CC(C)(C)C(=O)OC1(CCCCC1)N=O
Show InChI InChI=1S/C11H19NO3/c1-10(2,3)9(13)15-11(12-14)7-5-4-6-8-11/h4-8H2,1-3H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 150n/an/an/an/an/an/a



Wake Forest University

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle GAPDH assessed as residual enzyme activity after 60 mins by spectrophotometry


J Med Chem 56: 6583-92 (2013)


Article DOI: 10.1021/jm400057r
BindingDB Entry DOI: 10.7270/Q2PV6MSG
More data for this
Ligand-Target Pair
Glyceraldehyde-3-phosphate dehydrogenase


(Oryctolagus cuniculus)
BDBM50439263
PNG
(1-NITROSOCYCLOHEXYL ACETATE)
Show SMILES CC(=O)OC1(CCCCC1)N=O
Show InChI InChI=1S/C8H13NO3/c1-7(10)12-8(9-11)5-3-2-4-6-8/h2-6H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 200n/an/an/an/an/an/a



Wake Forest University

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle GAPDH assessed as residual enzyme activity after 60 mins by spectrophotometry


J Med Chem 56: 6583-92 (2013)


Article DOI: 10.1021/jm400057r
BindingDB Entry DOI: 10.7270/Q2PV6MSG
More data for this
Ligand-Target Pair
Glyceraldehyde-3-phosphate dehydrogenase


(Oryctolagus cuniculus)
BDBM50439264
PNG
(ANGELI'S SALT | Angeli''s Salt)
Show SMILES [O-]N([O-])N=O
Show InChI InChI=1S/N2O3/c3-1-2(4)5/q-2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 400n/an/an/an/an/an/a



Wake Forest University

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle GAPDH assessed as residual enzyme activity after 60 mins by spectrophotometry


J Med Chem 56: 6583-92 (2013)


Article DOI: 10.1021/jm400057r
BindingDB Entry DOI: 10.7270/Q2PV6MSG
More data for this
Ligand-Target Pair
Glyceraldehyde-3-phosphate dehydrogenase


(Oryctolagus cuniculus)
BDBM50439261
PNG
(1-NITROSOCYCLOHEXYL TRIFLUOROACETATE)
Show SMILES FC(F)(F)C(=O)OC1(CCCCC1)N=O
Show InChI InChI=1S/C8H10F3NO3/c9-8(10,11)6(13)15-7(12-14)4-2-1-3-5-7/h1-5H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 670n/an/an/an/an/an/a



Wake Forest University

Curated by ChEMBL


Assay Description
Inhibition of rabbit muscle GAPDH assessed as residual enzyme activity after 60 mins by spectrophotometry


J Med Chem 56: 6583-92 (2013)


Article DOI: 10.1021/jm400057r
BindingDB Entry DOI: 10.7270/Q2PV6MSG
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%