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Compile Data Set for Download or QSAR

Found 5 hits of ic50 for UniProtKB: P52904   
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
Pyruvate dehydrogenase E1 component subunit alpha,/beta, mitochondrial


(Pisum sativum)
BDBM50486217
PNG
(CLACYFOS)
Show SMILES COP(=O)(OC)C(C)OC(=O)COc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C12H15Cl2O6P/c1-8(21(16,17-2)18-3)20-12(15)7-19-11-5-4-9(13)6-10(11)14/h4-6,8H,7H2,1-3H3
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.28E+4n/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of PDHc in Vigna radiata var. radiata VC2778A shoot mitochondria assessed as decrease in rate of NADH formation using sodium pyruvate as s...


J Agric Food Chem 59: 4801-13 (2011)


Article DOI: 10.1021/jf104247w
BindingDB Entry DOI: 10.7270/Q2V69NFJ
More data for this
Ligand-Target Pair
Pyruvate dehydrogenase E1 component subunit alpha,/beta, mitochondrial


(Pisum sativum)
BDBM50486218
PNG
(CHEMBL2227928)
Show SMILES COP(=O)(COC(=O)COc1ccc(Cl)cc1Cl)OC
Show InChI InChI=1S/C11H13Cl2O6P/c1-16-20(15,17-2)7-19-11(14)6-18-10-4-3-8(12)5-9(10)13/h3-5H,6-7H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.97E+4n/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of PDHc in Vigna radiata var. radiata VC2778A shoot mitochondria assessed as decrease in rate of NADH formation using sodium pyruvate as s...


J Agric Food Chem 59: 4801-13 (2011)


Article DOI: 10.1021/jf104247w
BindingDB Entry DOI: 10.7270/Q2V69NFJ
More data for this
Ligand-Target Pair
Pyruvate dehydrogenase E1 component subunit alpha,/beta, mitochondrial


(Pisum sativum)
BDBM50486214
PNG
(CHEMBL2227973)
Show SMILES CCOP(=O)(OCC)C(C)OC(=O)COc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C14H19Cl2O6P/c1-4-20-23(18,21-5-2)10(3)22-14(17)9-19-13-7-6-11(15)8-12(13)16/h6-8,10H,4-5,9H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.31E+4n/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of PDHc in Vigna radiata var. radiata VC2778A shoot mitochondria assessed as decrease in rate of NADH formation using sodium pyruvate as s...


J Agric Food Chem 59: 4801-13 (2011)


Article DOI: 10.1021/jf104247w
BindingDB Entry DOI: 10.7270/Q2V69NFJ
More data for this
Ligand-Target Pair
Pyruvate dehydrogenase E1 component subunit alpha,/beta, mitochondrial


(Pisum sativum)
BDBM50486215
PNG
(CHEMBL2227682)
Show SMILES COP(=O)(OC)C(OC(=O)COc1ccc(Cl)cc1Cl)c1ccccc1
Show InChI InChI=1S/C17H17Cl2O6P/c1-22-26(21,23-2)17(12-6-4-3-5-7-12)25-16(20)11-24-15-9-8-13(18)10-14(15)19/h3-10,17H,11H2,1-2H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.54E+4n/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of PDHc in Vigna radiata var. radiata VC2778A shoot mitochondria assessed as decrease in rate of NADH formation using sodium pyruvate as s...


J Agric Food Chem 59: 4801-13 (2011)


Article DOI: 10.1021/jf104247w
BindingDB Entry DOI: 10.7270/Q2V69NFJ
More data for this
Ligand-Target Pair
Pyruvate dehydrogenase E1 component subunit alpha,/beta, mitochondrial


(Pisum sativum)
BDBM50486213
PNG
((2,4-Dichlorophenoxy)Acetic Acid | 2,4-Dichlorophe...)
Show SMILES OC(=O)COc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C8H6Cl2O3/c9-5-1-2-7(6(10)3-5)13-4-8(11)12/h1-3H,4H2,(H,11,12)
UniProtKB/SwissProt

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MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>4.53E+6n/an/an/an/an/an/a



Central China Normal University

Curated by ChEMBL


Assay Description
Inhibition of PDHc in Pisum sativum Zhongwan-2 (pea) shoot mitochondria assessed as decrease in rate of NADH formation using sodium pyruvate as subst...


J Agric Food Chem 59: 4801-13 (2011)


Article DOI: 10.1021/jf104247w
BindingDB Entry DOI: 10.7270/Q2V69NFJ
More data for this
Ligand-Target Pair