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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fructose-1,6-bisphosphatase 1' and Ligand = 'BDBM50101406'   
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
Fructose-1,6-bisphosphatase 1


(Homo sapiens (Human))		BDBM50101406
PNG
(CHEMBL3393944)
Show SMILES OC(=O)CCc1c([nH]c2c(ccc(-c3ccc(F)cc3)c12)[N+]([O-])=O)C(O)=O
Show InChI InChI=1S/C18H13FN2O6/c19-10-3-1-9(2-4-10)11-5-7-13(21(26)27)17-15(11)12(6-8-14(22)23)16(20-17)18(24)25/h1-5,7,20H,6,8H2,(H,22,23)(H,24,25)
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PC sid
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Similars
Article
PubMed
n/an/a 2.40E+3n/an/an/an/an/an/a



Chinese Academy of Medical Sciences&Peking Union Medical College

Curated by ChEMBL


Assay Description
Inhibition of human liver FBPase expressed in Escherichia coli BL21(DE3) Rosetta cells assessed as reduction of NADP+ to NADPH by phosphoglucose isom...

Eur J Med Chem 90: 394-405 (2015)


Article DOI: 10.1016/j.ejmech.2014.11.049
BindingDB Entry DOI: 10.7270/Q2CJ8G7H
More data for this
Ligand-Target Pair