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Compile Data Set for Download or QSAR

Found 9 hits of ic50 for monomerid = 50118093   
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
Carnitine O-palmitoyltransferase 1, muscle isoform


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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PubMed
n/an/a 1.10E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CPT1B in heart mitochondria


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, muscle isoform


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a 6.03E+4n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human CPT1B


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Carnitine O-palmitoyltransferase 2, mitochondrial


(Rattus norvegicus)
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a>1.00E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of rat CPT2


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, liver isoform


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a>1.00E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human CPT1A


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Carnitine O-palmitoyltransferase 2, mitochondrial


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a>1.00E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human CPT2


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase C


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a 2.00E+5n/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Concentration required for 50% Inhibition of activity against Yersinia Protein-tyrosine phosphatase


J Med Chem 45: 3946-52 (2002)


BindingDB Entry DOI: 10.7270/Q2F76BW4
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a 2.50E+5n/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Concentration required for 50% Inhibition of activity against Protein Tyrosine Phosphatases 1B


J Med Chem 45: 3946-52 (2002)


BindingDB Entry DOI: 10.7270/Q2F76BW4
More data for this
Ligand-Target Pair
Carnitine O-palmitoyltransferase 1, muscle isoform


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a 5.10E+5n/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd.

Curated by ChEMBL


Assay Description
Inhibition of CPT1B in liver mitochondria


J Med Chem 54: 3109-52 (2011)


Article DOI: 10.1021/jm100809g
BindingDB Entry DOI: 10.7270/Q29K4CDQ
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein phosphatase F


(Homo sapiens (Human))
BDBM50118093
PNG
((4-Hydroxy-phenyl)-oxo-acetic acid | CHEMBL129918)
Show SMILES OC(=O)C(=O)c1ccc(O)cc1
Show InChI InChI=1S/C8H6O4/c9-6-3-1-5(2-4-6)7(10)8(11)12/h1-4,9H,(H,11,12)
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n/an/a 2.30E+6n/an/an/an/an/an/a



Brown University

Curated by ChEMBL


Assay Description
Concentration required for 50% Inhibition of activity against Protein-tyrosine phosphatase Lar


J Med Chem 45: 3946-52 (2002)


BindingDB Entry DOI: 10.7270/Q2F76BW4
More data for this
Ligand-Target Pair