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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fructose-1,6-bisphosphatase 1' and Ligand = 'BDBM50303883'   
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))
BDBM50303883
PNG
(4-Amino-L-propyl-2-[2-(5-phosphono)furanyl]benzimi...)
Show SMILES CCCn1c(nc2c(N)cccc12)-c1ccc(o1)P(O)(O)=O
Show InChI InChI=1S/C14H16N3O4P/c1-2-8-17-10-5-3-4-9(15)13(10)16-14(17)11-6-7-12(21-11)22(18,19)20/h3-7H,2,8,15H2,1H3,(H2,18,19,20)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.10E+3n/an/an/an/an/an/a



Metabasis Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human liver FBPase 1


J Med Chem 53: 441-51 (2010)


Article DOI: 10.1021/jm901420x
BindingDB Entry DOI: 10.7270/Q2N58MFJ
More data for this
Ligand-Target Pair
Fructose-1,6-bisphosphatase 1


(Rattus norvegicus)
BDBM50303883
PNG
(4-Amino-L-propyl-2-[2-(5-phosphono)furanyl]benzimi...)
Show SMILES CCCn1c(nc2c(N)cccc12)-c1ccc(o1)P(O)(O)=O
Show InChI InChI=1S/C14H16N3O4P/c1-2-8-17-10-5-3-4-9(15)13(10)16-14(17)11-6-7-12(21-11)22(18,19)20/h3-7H,2,8,15H2,1H3,(H2,18,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Metabasis Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibition of rat liver FBPase 1


J Med Chem 53: 441-51 (2010)


Article DOI: 10.1021/jm901420x
BindingDB Entry DOI: 10.7270/Q2N58MFJ
More data for this
Ligand-Target Pair