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Compile Data Set for Download or QSAR

Found 4 hits with Last Name = 'durkee' and Initial = 'sc'   
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
4-aminobutyrate aminotransferase, mitochondrial


(Sus scrofa)
BDBM50024970
PNG
((2E)-4-ammonio-2-(hydroxymethyl)but-2-enoate | CHE...)
Show SMILES [NH3+]C\C=C(/CO)C([O-])=O
Show InChI InChI=1S/C5H9NO3/c6-2-1-4(3-7)5(8)9/h1,7H,2-3,6H2,(H,8,9)/b4-1+
PDB
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Similars

PubMed
5.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for the inhibitory effect against Gamma-amino-N-butyrate transaminase from pig brain


J Med Chem 29: 764-70 (1986)


BindingDB Entry DOI: 10.7270/Q2668C6T
More data for this
Ligand-Target Pair
4-aminobutyrate aminotransferase, mitochondrial


(Homo sapiens (Human))
BDBM50024968
PNG
((2Z)-4-ammonio-2-(fluoromethyl)but-2-enoate | CHEM...)
Show SMILES [NH3+]C\C=C(/CF)C([O-])=O
Show InChI InChI=1S/C5H8FNO2/c6-3-4(1-2-7)5(8)9/h1H,2-3,7H2,(H,8,9)/b4-1+
PDB
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9.00E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for the inhibitory effect against Gamma-amino-N-butyrate transaminase from bacteria


J Med Chem 29: 764-70 (1986)


BindingDB Entry DOI: 10.7270/Q2668C6T
More data for this
Ligand-Target Pair
4-aminobutyrate aminotransferase, mitochondrial


(Sus scrofa)
BDBM50024968
PNG
((2Z)-4-ammonio-2-(fluoromethyl)but-2-enoate | CHEM...)
Show SMILES [NH3+]C\C=C(/CF)C([O-])=O
Show InChI InChI=1S/C5H8FNO2/c6-3-4(1-2-7)5(8)9/h1H,2-3,7H2,(H,8,9)/b4-1+
PDB
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1.90E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for the inhibitory effect against Gamma-amino-N-butyrate transaminase from pig brain


J Med Chem 29: 764-70 (1986)


BindingDB Entry DOI: 10.7270/Q2668C6T
More data for this
Ligand-Target Pair
4-aminobutyrate aminotransferase, mitochondrial


(Sus scrofa)
BDBM50024969
PNG
((2Z)-4-ammonio-2-(chloromethyl)but-2-enoate | CHEM...)
Show SMILES [NH3+]C\C=C(/CCl)C([O-])=O
Show InChI InChI=1S/C5H8ClNO2/c6-3-4(1-2-7)5(8)9/h1H,2-3,7H2,(H,8,9)/b4-1+
PDB
MMDB

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2.40E+4n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Compound was tested for the inhibitory effect against Gamma-amino-N-butyrate transaminase from pig brain


J Med Chem 29: 764-70 (1986)


BindingDB Entry DOI: 10.7270/Q2668C6T
More data for this
Ligand-Target Pair