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PubMed code 19748269

Compile data set for download or QSAR
Found 21 hits of Enzyme Inhibition Constant Data   
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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM12915
PNG
(2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one |...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 500n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM12915
PNG
(2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one |...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 500n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302392
PNG
(6-methoxy-3-(5-(3-methoxyphenyl)-1,2,4-oxadiazol-3...)
Show SMILES COc1cccc(c1)-c1nc(no1)-c1cc2cc(OC)ccc2[nH]c1=O
Show InChI InChI=1S/C19H15N3O4/c1-24-13-5-3-4-11(8-13)19-21-17(22-26-19)15-10-12-9-14(25-2)6-7-16(12)20-18(15)23/h3-10H,1-2H3,(H,20,23)
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n/an/a 900n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM12915
PNG
(2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one |...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 900n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50302392
PNG
(6-methoxy-3-(5-(3-methoxyphenyl)-1,2,4-oxadiazol-3...)
Show SMILES COc1cccc(c1)-c1nc(no1)-c1cc2cc(OC)ccc2[nH]c1=O
Show InChI InChI=1S/C19H15N3O4/c1-24-13-5-3-4-11(8-13)19-21-17(22-26-19)15-10-12-9-14(25-2)6-7-16(12)20-18(15)23/h3-10H,1-2H3,(H,20,23)
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n/an/a 900n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302392
PNG
(6-methoxy-3-(5-(3-methoxyphenyl)-1,2,4-oxadiazol-3...)
Show SMILES COc1cccc(c1)-c1nc(no1)-c1cc2cc(OC)ccc2[nH]c1=O
Show InChI InChI=1S/C19H15N3O4/c1-24-13-5-3-4-11(8-13)19-21-17(22-26-19)15-10-12-9-14(25-2)6-7-16(12)20-18(15)23/h3-10H,1-2H3,(H,20,23)
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302389
PNG
(3-(benzo[d]thiazol-2-yl)-7-hydroxy-2H-chromen-2-on...)
Show SMILES Oc1ccc2cc(-c3nc4ccccc4s3)c(=O)oc2c1
Show InChI InChI=1S/C16H9NO3S/c18-10-6-5-9-7-11(16(19)20-13(9)8-10)15-17-12-3-1-2-4-14(12)21-15/h1-8,18H
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n/an/a 3.00E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50302389
PNG
(3-(benzo[d]thiazol-2-yl)-7-hydroxy-2H-chromen-2-on...)
Show SMILES Oc1ccc2cc(-c3nc4ccccc4s3)c(=O)oc2c1
Show InChI InChI=1S/C16H9NO3S/c18-10-6-5-9-7-11(16(19)20-13(9)8-10)15-17-12-3-1-2-4-14(12)21-15/h1-8,18H
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n/an/a 4.00E+3n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302393
PNG
(3-(6-chloro-2-oxobenzo[d]oxazol-3(2H)-yl)-N-phenyl...)
Show SMILES Clc1ccc2n(CCC(=O)Nc3ccccc3)c(=O)oc2c1
Show InChI InChI=1S/C16H13ClN2O3/c17-11-6-7-13-14(10-11)22-16(21)19(13)9-8-15(20)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,20)
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n/an/a 1.20E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302389
PNG
(3-(benzo[d]thiazol-2-yl)-7-hydroxy-2H-chromen-2-on...)
Show SMILES Oc1ccc2cc(-c3nc4ccccc4s3)c(=O)oc2c1
Show InChI InChI=1S/C16H9NO3S/c18-10-6-5-9-7-11(16(19)20-13(9)8-10)15-17-12-3-1-2-4-14(12)21-15/h1-8,18H
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n/an/a 1.40E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302393
PNG
(3-(6-chloro-2-oxobenzo[d]oxazol-3(2H)-yl)-N-phenyl...)
Show SMILES Clc1ccc2n(CCC(=O)Nc3ccccc3)c(=O)oc2c1
Show InChI InChI=1S/C16H13ClN2O3/c17-11-6-7-13-14(10-11)22-16(21)19(13)9-8-15(20)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,20)
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n/an/a 1.90E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302391
PNG
(1,7-dimethyl-1H-pyrazolo[3,4-b]quinolin-3-yl 2-phe...)
Show SMILES Cc1ccc2cc3c(OC(=O)COc4ccccc4)nn(C)c3nc2c1
Show InChI InChI=1S/C20H17N3O3/c1-13-8-9-14-11-16-19(21-17(14)10-13)23(2)22-20(16)26-18(24)12-25-15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
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n/an/a 3.80E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50302391
PNG
(1,7-dimethyl-1H-pyrazolo[3,4-b]quinolin-3-yl 2-phe...)
Show SMILES Cc1ccc2cc3c(OC(=O)COc4ccccc4)nn(C)c3nc2c1
Show InChI InChI=1S/C20H17N3O3/c1-13-8-9-14-11-16-19(21-17(14)10-13)23(2)22-20(16)26-18(24)12-25-15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
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n/an/a 4.70E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302394
PNG
(3-(2-methoxy-6-phenylpyridin-3-yl)-5-(pyridin-4-yl...)
Show SMILES COc1nc(ccc1-c1noc(n1)-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C19H14N4O2/c1-24-19-15(7-8-16(21-19)13-5-3-2-4-6-13)17-22-18(25-23-17)14-9-11-20-12-10-14/h2-12H,1H3
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n/an/a 7.80E+4n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302395
PNG
(3-(5-(2-methoxyphenyl)-1,2,4-oxadiazol-3-yl)-6-met...)
Show SMILES COc1ccccc1-c1nc(no1)-c1cc2cc(C)ccc2[nH]c1=O
Show InChI InChI=1S/C19H15N3O3/c1-11-7-8-15-12(9-11)10-14(18(23)20-15)17-21-19(25-22-17)13-5-3-4-6-16(13)24-2/h3-10H,1-2H3,(H,20,23)
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM50302390
PNG
(CHEMBL579219 | methyl 5-((5,6-dimethylthieno[2,3-d...)
Show SMILES COC(=O)c1ccc(CSc2ncnc3sc(C)c(C)c23)o1
Show InChI InChI=1S/C15H14N2O3S2/c1-8-9(2)22-14-12(8)13(16-7-17-14)21-6-10-4-5-11(20-10)15(18)19-3/h4-5,7H,6H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of mouse recombinant PI3Kalpha expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50302393
PNG
(3-(6-chloro-2-oxobenzo[d]oxazol-3(2H)-yl)-N-phenyl...)
Show SMILES Clc1ccc2n(CCC(=O)Nc3ccccc3)c(=O)oc2c1
Show InChI InChI=1S/C16H13ClN2O3/c17-11-6-7-13-14(10-11)22-16(21)19(13)9-8-15(20)18-12-4-2-1-3-5-12/h1-7,10H,8-9H2,(H,18,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302390
PNG
(CHEMBL579219 | methyl 5-((5,6-dimethylthieno[2,3-d...)
Show SMILES COC(=O)c1ccc(CSc2ncnc3sc(C)c(C)c23)o1
Show InChI InChI=1S/C15H14N2O3S2/c1-8-9(2)22-14-12(8)13(16-7-17-14)21-6-10-4-5-11(20-10)15(18)19-3/h4-5,7H,6H2,1-3H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302391
PNG
(1,7-dimethyl-1H-pyrazolo[3,4-b]quinolin-3-yl 2-phe...)
Show SMILES Cc1ccc2cc3c(OC(=O)COc4ccccc4)nn(C)c3nc2c1
Show InChI InChI=1S/C20H17N3O3/c1-13-8-9-14-11-16-19(21-17(14)10-13)23(2)22-20(16)26-18(24)12-25-15-6-4-3-5-7-15/h3-11H,12H2,1-2H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50302394
PNG
(3-(2-methoxy-6-phenylpyridin-3-yl)-5-(pyridin-4-yl...)
Show SMILES COc1nc(ccc1-c1noc(n1)-c1ccncc1)-c1ccccc1
Show InChI InChI=1S/C19H14N4O2/c1-24-19-15(7-8-16(21-19)13-5-3-2-4-6-13)17-22-18(25-23-17)14-9-11-20-12-10-14/h2-12H,1H3
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Article
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of human recombinant PI3Kbeta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50302390
PNG
(CHEMBL579219 | methyl 5-((5,6-dimethylthieno[2,3-d...)
Show SMILES COC(=O)c1ccc(CSc2ncnc3sc(C)c(C)c23)o1
Show InChI InChI=1S/C15H14N2O3S2/c1-8-9(2)22-14-12(8)13(16-7-17-14)21-6-10-4-5-11(20-10)15(18)19-3/h4-5,7H,6H2,1-3H3
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Auckland

Curated by ChEMBL


Assay Description
Inhibition of recombinant PI3Kdelta expressed in baculovirus-infected Sf21 cells


Bioorg Med Chem Lett 19: 5842-7 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.087
BindingDB Entry DOI: 10.7270/Q2W0960K
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%