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Compile Data Set for Download or QSAR

Found 15 hits Enz. Inhib. hit(s) with Target = 'Phospholipid transfer protein'   
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
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325136
PNG
(CHEMBL1222668 | N-(4,5-diphenyl-1,3-selenazol-2-yl...)
Show SMILES Oc1ccc(cc1O)C(=O)Nc1nc(c([se]1)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C22H16N2O3Se/c25-17-12-11-16(13-18(17)26)21(27)24-22-23-19(14-7-3-1-4-8-14)20(28-22)15-9-5-2-6-10-15/h1-13,25-26H,(H,23,24,27)
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n/an/a 8.00E+3n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325138
PNG
(CHEMBL1222737 | N-(5-butyl-4-(4-hydroxyphenyl)-1,3...)
Show SMILES CCCCc1[se]c(NC(=O)c2cc(O)c(O)c(O)c2)nc1-c1ccc(O)cc1
Show InChI InChI=1S/C20H20N2O5Se/c1-2-3-4-16-17(11-5-7-13(23)8-6-11)21-20(28-16)22-19(27)12-9-14(24)18(26)15(25)10-12/h5-10,23-26H,2-4H2,1H3,(H,21,22,27)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325137
PNG
(CHEMBL1222733 | N-(4,5-diphenyl-1,3-selenazol-2-yl...)
Show SMILES Oc1cc(cc(O)c1O)C(=O)Nc1nc(c([se]1)-c1ccccc1)-c1ccccc1
Show InChI InChI=1S/C22H16N2O4Se/c25-16-11-15(12-17(26)19(16)27)21(28)24-22-23-18(13-7-3-1-4-8-13)20(29-22)14-9-5-2-6-10-14/h1-12,25-27H,(H,23,24,28)
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n/an/a 2.50E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325130
PNG
(CHEMBL1222504 | N-(5-ethyl-4-(4-hydroxyphenyl)-1,3...)
Show SMILES CCc1[se]c(NC(=O)c2cc(O)c(O)c(O)c2)nc1-c1ccc(O)cc1
Show InChI InChI=1S/C18H16N2O5Se/c1-2-14-15(9-3-5-11(21)6-4-9)19-18(26-14)20-17(25)10-7-12(22)16(24)13(23)8-10/h3-8,21-24H,2H2,1H3,(H,19,20,25)
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n/an/a 3.20E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325135
PNG
(CHEMBL1222666 | N-(5-benzyl-4-(4-hydroxyphenyl)-1,...)
Show SMILES Oc1ccc(cc1)-c1nc(NC(=O)c2cc(O)c(O)c(O)c2)[se]c1Cc1ccccc1
Show InChI InChI=1S/C23H18N2O5Se/c26-16-8-6-14(7-9-16)20-19(10-13-4-2-1-3-5-13)31-23(24-20)25-22(30)15-11-17(27)21(29)18(28)12-15/h1-9,11-12,26-29H,10H2,(H,24,25,30)
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n/an/a 3.20E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325133
PNG
(CHEMBL1222599 | N-(5-benzyl-4-(4-hydroxyphenyl)-1,...)
Show SMILES Oc1ccc(cc1)-c1nc(NC(=O)c2ccc(O)c(O)c2)[se]c1Cc1ccccc1
Show InChI InChI=1S/C23H18N2O4Se/c26-17-9-6-15(7-10-17)21-20(12-14-4-2-1-3-5-14)30-23(24-21)25-22(29)16-8-11-18(27)19(28)13-16/h1-11,13,26-28H,12H2,(H,24,25,29)
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n/an/a 3.50E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325140
PNG
(CHEMBL1222815 | N-(5-butyl-4-(4-hydroxyphenyl)-1,3...)
Show SMILES CCCCc1[se]c(NC(=O)c2ccc(Cl)cc2)nc1-c1ccc(O)cc1
Show InChI InChI=1S/C20H19ClN2O2Se/c1-2-3-4-17-18(13-7-11-16(24)12-8-13)22-20(26-17)23-19(25)14-5-9-15(21)10-6-14/h5-12,24H,2-4H2,1H3,(H,22,23,25)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325129
PNG
(CHEMBL1222667 | N-(5-benzyl-4-(4-hydroxyphenyl)-1,...)
Show SMILES CCCCCC(=O)Nc1nc(c(Cc2ccccc2)[se]1)-c1ccc(O)cc1
Show InChI InChI=1S/C22H24N2O2Se/c1-2-3-5-10-20(26)23-22-24-21(17-11-13-18(25)14-12-17)19(27-22)15-16-8-6-4-7-9-16/h4,6-9,11-14,25H,2-3,5,10,15H2,1H3,(H,23,24,26)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325132
PNG
(4-chloro-N-(5-ethyl-4-(4-hydroxyphenyl)-1,3-selena...)
Show SMILES CCc1[se]c(NC(=O)c2ccc(Cl)cc2)nc1-c1ccc(O)cc1
Show InChI InChI=1S/C18H15ClN2O2Se/c1-2-15-16(11-5-9-14(22)10-6-11)20-18(24-15)21-17(23)12-3-7-13(19)8-4-12/h3-10,22H,2H2,1H3,(H,20,21,23)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325139
PNG
(CHEMBL1222814 | N-(5-butyl-4-(4-hydroxyphenyl)-1,3...)
Show SMILES CCCCc1[se]c(NC(C)=O)nc1-c1ccc(O)cc1
Show InChI InChI=1S/C15H18N2O2Se/c1-3-4-5-13-14(11-6-8-12(19)9-7-11)17-15(20-13)16-10(2)18/h6-9,19H,3-5H2,1-2H3,(H,16,17,18)
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n/an/a 6.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325127
PNG
(CHEMBL1222598 | N-(5-benzyl-4-(4-methoxyphenyl)-1,...)
Show SMILES COc1ccc(cc1)-c1nc(NC(=O)c2ccc(OC)c(OC)c2)[se]c1Cc1ccccc1
Show InChI InChI=1S/C26H24N2O4Se/c1-30-20-12-9-18(10-13-20)24-23(15-17-7-5-4-6-8-17)33-26(27-24)28-25(29)19-11-14-21(31-2)22(16-19)32-3/h4-14,16H,15H2,1-3H3,(H,27,28,29)
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n/an/a 8.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325142
PNG
(CHEMBL1222817 | N-(5-butyl-4-(4-methoxyphenyl)-1,3...)
Show SMILES CCCCc1[se]c(NC(=O)c2ccc(OC)c(OC)c2)nc1-c1ccc(OC)cc1
Show InChI InChI=1S/C23H26N2O4Se/c1-5-6-7-20-21(15-8-11-17(27-2)12-9-15)24-23(30-20)25-22(26)16-10-13-18(28-3)19(14-16)29-4/h8-14H,5-7H2,1-4H3,(H,24,25,26)
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n/an/a 8.00E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325134
PNG
(CHEMBL1222600 | N-(5-benzyl-4-(4-methoxyphenyl)-1,...)
Show SMILES COc1ccc(cc1)-c1nc(NC(=O)c2ccc(cc2)[N+]([O-])=O)[se]c1Cc1ccccc1
Show InChI InChI=1S/C24H19N3O4Se/c1-31-20-13-9-17(10-14-20)22-21(15-16-5-3-2-4-6-16)32-24(25-22)26-23(28)18-7-11-19(12-8-18)27(29)30/h2-14H,15H2,1H3,(H,25,26,28)
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n/an/a 8.50E+4n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325131
PNG
(CHEMBL1222505 | N-(5-ethyl-4-(4-methoxyphenyl)-1,3...)
Show SMILES CCc1[se]c(NC(=O)c2ccc(OC)c(OC)c2)nc1-c1ccc(OC)cc1
Show InChI InChI=1S/C21H22N2O4Se/c1-5-18-19(13-6-9-15(25-2)10-7-13)22-21(28-18)23-20(24)14-8-11-16(26-3)17(12-14)27-4/h6-12H,5H2,1-4H3,(H,22,23,24)
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n/an/a 1.00E+5n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair
Phospholipid transfer protein


(Homo sapiens (Human))
BDBM50325141
PNG
(CHEMBL1222816 | N-(5-butyl-4-(4-methoxyphenyl)-1,3...)
Show SMILES CCCCc1[se]c(NC(=O)c2cc(OC)c(OC)c(OC)c2)nc1-c1ccc(OC)cc1
Show InChI InChI=1S/C24H28N2O5Se/c1-6-7-8-20-21(15-9-11-17(28-2)12-10-15)25-24(32-20)26-23(27)16-13-18(29-3)22(31-5)19(14-16)30-4/h9-14H,6-8H2,1-5H3,(H,25,26,27)
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n/an/a 1.50E+5n/an/an/an/an/an/a



Beijing Institute of Pharmacology and Toxicology

Curated by ChEMBL


Assay Description
Inhibition of PLTP


Bioorg Med Chem Lett 20: 5123-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.07.017
BindingDB Entry DOI: 10.7270/Q2K64J8P
More data for this
Ligand-Target Pair