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Compile Data Set for Download or QSAR

Found 21 hits with Last Name = 'hollenback' and Initial = 'd'   
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
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50144706
PNG
(6-(5-Chloro-2-ethoxy-phenyl)-N*4*-(4-chloro-phenyl...)
Show SMILES CCOc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1
Show InChI InChI=1S/C18H16Cl2N4O/c1-2-25-16-8-5-12(20)9-14(16)15-10-17(24-18(21)23-15)22-13-6-3-11(19)4-7-13/h3-10H,2H2,1H3,(H3,21,22,23,24)
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n/an/a 17n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172956
PNG
(4-(5-Chloro-2-methoxy-phenyl)-N-(4-chloro-phenyl)-...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(Cl)cc2)c1
Show InChI InChI=1S/C18H15Cl2N3O/c1-24-16-7-4-13(20)10-15(16)11-8-17(21)23-18(9-11)22-14-5-2-12(19)3-6-14/h2-10H,1H3,(H3,21,22,23)
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n/an/a 40n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172950
PNG
(4-[6-Amino-4-(5-chloro-2-ethoxy-phenyl)-pyridin-2-...)
Show SMILES CCOc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(C=O)cc2)c1
Show InChI InChI=1S/C20H18ClN3O2/c1-2-26-18-8-5-15(21)11-17(18)14-9-19(22)24-20(10-14)23-16-6-3-13(12-25)4-7-16/h3-12H,2H2,1H3,(H3,22,23,24)
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n/an/a 50n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172955
PNG
(4-(5-Chloro-2-ethoxy-phenyl)-N-(4-chloro-phenyl)-p...)
Show SMILES CCOc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(Cl)cc2)c1
Show InChI InChI=1S/C19H17Cl2N3O/c1-2-25-17-8-5-14(21)11-16(17)12-9-18(22)24-19(10-12)23-15-6-3-13(20)4-7-15/h3-11H,2H2,1H3,(H3,22,23,24)
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n/an/a 50n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50144724
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*4*-(4-chloro-pheny...)
Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)nc(N)n1
Show InChI InChI=1S/C17H14Cl2N4O/c1-24-15-7-4-11(19)8-13(15)14-9-16(23-17(20)22-14)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)
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n/an/a 54n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172951
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N-(4-chloro-phenyl)-...)
Show SMILES COc1ccc(Cl)cc1-c1nc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C16H13Cl2N5O/c1-24-13-7-4-10(18)8-12(13)14-21-15(19)23-16(22-14)20-11-5-2-9(17)3-6-11/h2-8H,1H3,(H3,19,20,21,22,23)
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n/an/a 70n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172951
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N-(4-chloro-phenyl)-...)
Show SMILES COc1ccc(Cl)cc1-c1nc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C16H13Cl2N5O/c1-24-13-7-4-10(18)8-12(13)14-21-15(19)23-16(22-14)20-11-5-2-9(17)3-6-11/h2-8H,1H3,(H3,19,20,21,22,23)
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n/an/a 70n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172952
PNG
(CHEMBL193588 | {4-[6-Amino-4-(5-chloro-2-ethoxy-ph...)
Show SMILES CCOc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(CO)cc2)c1
Show InChI InChI=1S/C20H20ClN3O2/c1-2-26-18-8-5-15(21)11-17(18)14-9-19(22)24-20(10-14)23-16-6-3-13(12-25)4-7-16/h3-11,25H,2,12H2,1H3,(H3,22,23,24)
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n/an/a 99n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172949
PNG
(6-(5-Chloro-2-ethoxy-phenyl)-N-(4-chloro-phenyl)-[...)
Show SMILES CCOc1ccc(Cl)cc1-c1nc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C17H15Cl2N5O/c1-2-25-14-8-5-11(19)9-13(14)15-22-16(20)24-17(23-15)21-12-6-3-10(18)4-7-12/h3-9H,2H2,1H3,(H3,20,21,22,23,24)
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n/an/a 140n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172949
PNG
(6-(5-Chloro-2-ethoxy-phenyl)-N-(4-chloro-phenyl)-[...)
Show SMILES CCOc1ccc(Cl)cc1-c1nc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C17H15Cl2N5O/c1-2-25-14-8-5-11(19)9-13(14)15-22-16(20)24-17(23-15)21-12-6-3-10(18)4-7-12/h3-9H,2H2,1H3,(H3,20,21,22,23,24)
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n/an/a 140n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172959
PNG
(4-(5-Chloro-2-methoxy-phenyl)-N-p-tolyl-pyridine-2...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(C)cc2)c1
Show InChI InChI=1S/C19H18ClN3O/c1-12-3-6-15(7-4-12)22-19-10-13(9-18(21)23-19)16-11-14(20)5-8-17(16)24-2/h3-11H,1-2H3,(H3,21,22,23)
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n/an/a 240n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172948
PNG
(4-[6-Amino-4-(5-chloro-2-methoxy-phenyl)-pyridin-2...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(C=O)cc2)c1
Show InChI InChI=1S/C19H16ClN3O2/c1-25-17-7-4-14(20)10-16(17)13-8-18(21)23-19(9-13)22-15-5-2-12(11-24)3-6-15/h2-11H,1H3,(H3,21,22,23)
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n/an/a 260n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172954
PNG
(4-(5-Chloro-2-ethoxy-phenyl)-N-p-tolyl-pyridine-2,...)
Show SMILES CCOc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(C)cc2)c1
Show InChI InChI=1S/C20H20ClN3O/c1-3-25-18-9-6-15(21)12-17(18)14-10-19(22)24-20(11-14)23-16-7-4-13(2)5-8-16/h4-12H,3H2,1-2H3,(H3,22,23,24)
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n/an/a 490n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50144713
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*2*-(4-chloro-pheny...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C17H14Cl2N4O/c1-24-15-7-4-11(19)8-13(15)14-9-16(20)23-17(22-14)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50144713
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*2*-(4-chloro-pheny...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)nc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C17H14Cl2N4O/c1-24-15-7-4-11(19)8-13(15)14-9-16(20)23-17(22-14)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)
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n/an/a 2.05E+3n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172953
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*2*-(4-chloro-pheny...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)cc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C18H15Cl2N3O/c1-24-17-7-4-12(20)8-15(17)16-9-13(21)10-18(23-16)22-14-5-2-11(19)3-6-14/h2-10H,1H3,(H3,21,22,23)
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n/an/a 6.50E+3n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50144728
PNG
(2-(5-Chloro-2-methoxy-phenyl)-N-(4-chloro-phenyl)-...)
Show SMILES COc1ccc(Cl)cc1-c1nc(N)cc(Nc2ccc(Cl)cc2)n1
Show InChI InChI=1S/C17H14Cl2N4O/c1-24-14-7-4-11(19)8-13(14)17-22-15(20)9-16(23-17)21-12-5-2-10(18)3-6-12/h2-9H,1H3,(H3,20,21,22,23)
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n/an/a 7.00E+3n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172958
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*4*-(4-chloro-pheny...)
Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(Cl)cc2)cc(N)n1
Show InChI InChI=1S/C18H15Cl2N3O/c1-24-17-7-4-12(20)8-15(17)16-9-14(10-18(21)23-16)22-13-5-2-11(19)3-6-13/h2-10H,1H3,(H3,21,22,23)
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n/an/a 1.80E+4n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172960
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*2*-p-tolyl-pyridin...)
Show SMILES COc1ccc(Cl)cc1-c1cc(N)cc(Nc2ccc(C)cc2)n1
Show InChI InChI=1S/C19H18ClN3O/c1-12-3-6-15(7-4-12)22-19-11-14(21)10-17(23-19)16-9-13(20)5-8-18(16)24-2/h3-11H,1-2H3,(H3,21,22,23)
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n/an/a 2.90E+4n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172957
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*4*-p-tolyl-pyridin...)
Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(C)cc2)cc(N)n1
Show InChI InChI=1S/C19H18ClN3O/c1-12-3-6-14(7-4-12)22-15-10-17(23-19(21)11-15)16-9-13(20)5-8-18(16)24-2/h3-11H,1-2H3,(H3,21,22,23)
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n/an/a 3.50E+4n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair
1-acyl-sn-glycerol-3-phosphate acyltransferase beta


(Homo sapiens (Human))
BDBM50172957
PNG
(6-(5-Chloro-2-methoxy-phenyl)-N*4*-p-tolyl-pyridin...)
Show SMILES COc1ccc(Cl)cc1-c1cc(Nc2ccc(C)cc2)cc(N)n1
Show InChI InChI=1S/C19H18ClN3O/c1-12-3-6-14(7-4-12)22-15-10-17(23-19(21)11-15)16-9-13(20)5-8-18(16)24-2/h3-11H,1-2H3,(H3,21,22,23)
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n/an/a>4.00E+4n/an/an/an/an/an/a



Cell Therapeutics, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against Lysophosphatidic acid acyltransferase-beta enzyme overexpressed in Sf9 insect cell membrane


Bioorg Med Chem Lett 15: 4703-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.07.055
BindingDB Entry DOI: 10.7270/Q29G5MB2
More data for this
Ligand-Target Pair