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Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Pyridoxal phosphate phosphatase' AND taxid = 10090   
Target
(Institution)
LigandTarget
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
Pyridoxal phosphate phosphatase


(Mus musculus)
BDBM50084936
PNG
(CHEMBL3427368)
Show SMILES Cc1ncc(CCP(O)(O)=O)c(C=O)c1O
Show InChI InChI=1S/C9H12NO5P/c1-6-9(12)8(5-11)7(4-10-6)2-3-16(13,14)15/h4-5,12H,2-3H2,1H3,(H2,13,14,15)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 7.90E+4n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant mouse brain PDXP expressed in Escherichia coli BL21 (DE3) cells assessed as pyridoxal 5' phosphate dephosphorylation preinc...


Citation and Details
More data for this
Ligand-Target Pair
Pyridoxal phosphate phosphatase


(Mus musculus)
BDBM50084935
PNG
(CHEMBL3427369)
Show SMILES Cc1ncc(\C=C\P(O)(O)=O)c(C=O)c1O
Show InChI InChI=1S/C9H10NO5P/c1-6-9(12)8(5-11)7(4-10-6)2-3-16(13,14)15/h2-5,12H,1H3,(H2,13,14,15)/b3-2+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 2.46E+5n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant mouse brain PDXP expressed in Escherichia coli BL21 (DE3) cells assessed as pyridoxal 5' phosphate dephosphorylation preinc...


Citation and Details
More data for this
Ligand-Target Pair
Pyridoxal phosphate phosphatase


(Mus musculus)
BDBM50084933
PNG
(CHEMBL3427371)
Show SMILES Cc1ncc(\C=C\P(O)(O)=O)c(CO)c1O
Show InChI InChI=1S/C9H12NO5P/c1-6-9(12)8(5-11)7(4-10-6)2-3-16(13,14)15/h2-4,11-12H,5H2,1H3,(H2,13,14,15)/b3-2+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.30E+6n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant mouse brain PDXP expressed in Escherichia coli BL21 (DE3) cells assessed as pyridoxal 5' phosphate dephosphorylation preinc...


Citation and Details
More data for this
Ligand-Target Pair
Pyridoxal phosphate phosphatase


(Mus musculus)
BDBM50084934
PNG
(CHEMBL3427370)
Show SMILES Cc1ncc(CCP(O)(O)=O)c(CO)c1O
Show InChI InChI=1S/C9H14NO5P/c1-6-9(12)8(5-11)7(4-10-6)2-3-16(13,14)15/h4,11-12H,2-3,5H2,1H3,(H2,13,14,15)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars

AffyNet 
PDB
Article
PubMed
n/an/a 1.30E+6n/an/an/an/an/an/a



University of W£rzburg

Curated by ChEMBL


Assay Description
Inhibition of recombinant mouse brain PDXP expressed in Escherichia coli BL21 (DE3) cells assessed as pyridoxal 5' phosphate dephosphorylation preinc...


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)