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Compile Data Set for Download or QSAR

Found 1 hit of ki data for polymerid = 50004710   
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
NADP-dependent malic enzyme


(Escherichia coli (strain K12))		BDBM50338502
PNG
(5-O-phosphate-1-N-(4'-(4''-methoxyhenyl))-[1',2',3...)
Show SMILES COc1ccc(cc1)-c1cn(nn1)[C@@H]1O[C@H](COP(O)(O)=O)[C@@H](O)[C@H]1O |r|
Show InChI InChI=1S/C14H18N3O8P/c1-23-9-4-2-8(3-5-9)10-6-17(16-15-10)14-13(19)12(18)11(25-14)7-24-26(20,21)22/h2-6,11-14,18-19H,7H2,1H3,(H2,20,21,22)/t11-,12-,13-,14-/m1/s1
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
 5.70E+4n/an/an/an/an/an/an/an/a



Institute of Chemical Physics

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli K-12 recombinant NAD-dependent malic enzyme by Dixon plot

Bioorg Med Chem Lett 21: 1667-9 (2011)


Article DOI: 10.1016/j.bmcl.2011.01.107
BindingDB Entry DOI: 10.7270/Q2JD4X3R
More data for this
Ligand-Target Pair