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PubMed code 20189103

Compile data set for download or QSAR
Found 36 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))
BDBM81369
PNG
(SW13)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-24(17)36-26(33-23-10-5-8-18(2)27(23)30(36)38)16-35-25-12-6-9-22(32)28(25)29(34-35)19-13-20(31)15-21(37)14-19/h3-15,37H,16,32H2,1-2H3
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Article
PubMed
n/an/a 0.700n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81371
PNG
(SW18)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-20(31)25(37)15-19/h3-15,37H,16,32H2,1-2H3
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PubMed
n/an/a 5n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81373
PNG
(SW30)
Show SMILES Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C27H23N5O2/c1-17-8-3-4-13-22(17)32-24(29-20-11-5-9-18(2)25(20)27(32)34)16-31-23-14-6-10-19(28)26(23)21(30-31)12-7-15-33/h3-6,8-11,13-14,33H,15-16,28H2,1-2H3
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n/an/a 7n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM50324735
PNG
((5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc2nccnc2c1
Show InChI InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)
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PubMed
n/an/a 8n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81370
PNG
(SW14)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-25(37)20(31)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 9n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM36411
PNG
(2-((4-amino-3-(3-hydroxyphenyl)-1H-pyrazolo[3,4-d]...)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C28H23N7O2/c1-16-7-3-4-12-21(16)35-22(32-20-11-5-8-17(2)23(20)28(35)37)14-34-27-24(26(29)30-15-31-27)25(33-34)18-9-6-10-19(36)13-18/h3-13,15,36H,14H2,1-2H3,(H2,29,30,31)
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PubMed
n/an/a 11n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81368
PNG
(PIK90)
Show SMILES COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC
Show InChI InChI=1S/C18H17N5O3/c1-25-13-6-5-12-14(15(13)26-2)21-18(23-9-8-20-16(12)23)22-17(24)11-4-3-7-19-10-11/h3-7,10H,8-9H2,1-2H3,(H,21,22,24)
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n/an/a 11n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81372
PNG
(SW19)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc4[nH]ccc34)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C32H26N6O/c1-19-8-3-4-14-26(19)38-28(35-25-13-5-9-20(2)29(25)32(38)39)18-37-27-15-7-11-23(33)30(27)31(36-37)22-10-6-12-24-21(22)16-17-34-24/h3-17,34H,18,33H2,1-2H3
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n/an/a 16n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81368
PNG
(PIK90)
Show SMILES COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC
Show InChI InChI=1S/C18H17N5O3/c1-25-13-6-5-12-14(15(13)26-2)21-18(23-9-8-20-16(12)23)22-17(24)11-4-3-7-19-10-11/h3-7,10H,8-9H2,1-2H3,(H,21,22,24)
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PubMed
n/an/a 18n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81370
PNG
(SW14)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-25(37)20(31)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 21n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81369
PNG
(SW13)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-24(17)36-26(33-23-10-5-8-18(2)27(23)30(36)38)16-35-25-12-6-9-22(32)28(25)29(34-35)19-13-20(31)15-21(37)14-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 33n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81371
PNG
(SW18)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-20(31)25(37)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 38n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81368
PNG
(PIK90)
Show SMILES COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC
Show InChI InChI=1S/C18H17N5O3/c1-25-13-6-5-12-14(15(13)26-2)21-18(23-9-8-20-16(12)23)22-17(24)11-4-3-7-19-10-11/h3-7,10H,8-9H2,1-2H3,(H,21,22,24)
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PubMed
n/an/a 58n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM50324735
PNG
((5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc2nccnc2c1
Show InChI InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)
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n/an/a 60n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM36411
PNG
(2-((4-amino-3-(3-hydroxyphenyl)-1H-pyrazolo[3,4-d]...)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C28H23N7O2/c1-16-7-3-4-12-21(16)35-22(32-20-11-5-8-17(2)23(20)28(35)37)14-34-27-24(26(29)30-15-31-27)25(33-34)18-9-6-10-19(36)13-18/h3-13,15,36H,14H2,1-2H3,(H2,29,30,31)
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n/an/a 162n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81369
PNG
(SW13)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-24(17)36-26(33-23-10-5-8-18(2)27(23)30(36)38)16-35-25-12-6-9-22(32)28(25)29(34-35)19-13-20(31)15-21(37)14-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 221n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM81367
PNG
(PIK293)
Show SMILES Cc1ccccc1-n1c(Cn2ncc3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C24H21N5O/c1-15-7-3-4-11-20(15)29-22(27-19-10-5-8-16(2)23(19)24(29)30)14-28-21-12-6-9-18(25)17(21)13-26-28/h3-13H,14,25H2,1-2H3
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n/an/a 237n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM50324735
PNG
((5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc2nccnc2c1
Show InChI InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)
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n/an/a 270n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (human))
BDBM50324735
PNG
((5E)-5-(QUINOXALIN-6-YLMETHYLENE)-1,3-THIAZOLIDINE...)
Show SMILES OC1=NC(=O)C(S1)=Cc1ccc2nccnc2c1
Show InChI InChI=1S/C12H7N3O2S/c16-11-10(18-12(17)15-11)6-7-1-2-8-9(5-7)14-4-3-13-8/h1-6H,(H,15,16,17)
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n/an/a 300n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81368
PNG
(PIK90)
Show SMILES COc1ccc2C3=NCCN3C(NC(=O)c3cccnc3)=Nc2c1OC
Show InChI InChI=1S/C18H17N5O3/c1-25-13-6-5-12-14(15(13)26-2)21-18(23-9-8-20-16(12)23)22-17(24)11-4-3-7-19-10-11/h3-7,10H,8-9H2,1-2H3,(H,21,22,24)
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n/an/a 350n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81372
PNG
(SW19)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc4[nH]ccc34)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C32H26N6O/c1-19-8-3-4-14-26(19)38-28(35-25-13-5-9-20(2)29(25)32(38)39)18-37-27-15-7-11-23(33)30(27)31(36-37)22-10-6-12-24-21(22)16-17-34-24/h3-17,34H,18,33H2,1-2H3
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n/an/a 376n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM36411
PNG
(2-((4-amino-3-(3-hydroxyphenyl)-1H-pyrazolo[3,4-d]...)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C28H23N7O2/c1-16-7-3-4-12-21(16)35-22(32-20-11-5-8-17(2)23(20)28(35)37)14-34-27-24(26(29)30-15-31-27)25(33-34)18-9-6-10-19(36)13-18/h3-13,15,36H,14H2,1-2H3,(H2,29,30,31)
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n/an/a 486n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81370
PNG
(SW14)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-25(37)20(31)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 697n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81373
PNG
(SW30)
Show SMILES Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C27H23N5O2/c1-17-8-3-4-13-22(17)32-24(29-20-11-5-9-18(2)25(20)27(32)34)16-31-23-14-6-10-19(28)26(23)21(30-31)12-7-15-33/h3-6,8-11,13-14,33H,15-16,28H2,1-2H3
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n/an/a 740n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81369
PNG
(SW13)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cc(O)cc(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-24(17)36-26(33-23-10-5-8-18(2)27(23)30(36)38)16-35-25-12-6-9-22(32)28(25)29(34-35)19-13-20(31)15-21(37)14-19/h3-15,37H,16,32H2,1-2H3
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PubMed
n/an/a 1.24E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81373
PNG
(SW30)
Show SMILES Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C27H23N5O2/c1-17-8-3-4-13-22(17)32-24(29-20-11-5-9-18(2)25(20)27(32)34)16-31-23-14-6-10-19(28)26(23)21(30-31)12-7-15-33/h3-6,8-11,13-14,33H,15-16,28H2,1-2H3
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PubMed
n/an/a 1.30E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81371
PNG
(SW18)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-20(31)25(37)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 2.40E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81371
PNG
(SW18)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(F)c(O)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-20(31)25(37)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 6.70E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81372
PNG
(SW19)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc4[nH]ccc34)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C32H26N6O/c1-19-8-3-4-14-26(19)38-28(35-25-13-5-9-20(2)29(25)32(38)39)18-37-27-15-7-11-23(33)30(27)31(36-37)22-10-6-12-24-21(22)16-17-34-24/h3-17,34H,18,33H2,1-2H3
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n/an/a 7.90E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81370
PNG
(SW14)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3ccc(O)c(F)c3)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C30H24FN5O2/c1-17-7-3-4-11-23(17)36-26(33-22-10-5-8-18(2)27(22)30(36)38)16-35-24-12-6-9-21(32)28(24)29(34-35)19-13-14-25(37)20(31)15-19/h3-15,37H,16,32H2,1-2H3
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n/an/a 8.91E+3n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (human))
BDBM81367
PNG
(PIK293)
Show SMILES Cc1ccccc1-n1c(Cn2ncc3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C24H21N5O/c1-15-7-3-4-11-20(15)29-22(27-19-10-5-8-16(2)23(19)24(29)30)14-28-21-12-6-9-18(25)17(21)13-26-28/h3-13H,14,25H2,1-2H3
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PubMed
n/an/a 1.00E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81373
PNG
(SW30)
Show SMILES Cc1ccccc1-n1c(Cn2nc(C#CCO)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C27H23N5O2/c1-17-8-3-4-13-22(17)32-24(29-20-11-5-9-18(2)25(20)27(32)34)16-31-23-14-6-10-19(28)26(23)21(30-31)12-7-15-33/h3-6,8-11,13-14,33H,15-16,28H2,1-2H3
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n/an/a 8.50E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81367
PNG
(PIK293)
Show SMILES Cc1ccccc1-n1c(Cn2ncc3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C24H21N5O/c1-15-7-3-4-11-20(15)29-22(27-19-10-5-8-16(2)23(19)24(29)30)14-28-21-12-6-9-18(25)17(21)13-26-28/h3-13H,14,25H2,1-2H3
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PubMed
n/an/a>9.00E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM81372
PNG
(SW19)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc4[nH]ccc34)c3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C32H26N6O/c1-19-8-3-4-14-26(19)38-28(35-25-13-5-9-20(2)29(25)32(38)39)18-37-27-15-7-11-23(33)30(27)31(36-37)22-10-6-12-24-21(22)16-17-34-24/h3-17,34H,18,33H2,1-2H3
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n/an/a>9.00E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (human))
BDBM81367
PNG
(PIK293)
Show SMILES Cc1ccccc1-n1c(Cn2ncc3c(N)cccc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C24H21N5O/c1-15-7-3-4-11-20(15)29-22(27-19-10-5-8-16(2)23(19)24(29)30)14-28-21-12-6-9-18(25)17(21)13-26-28/h3-13H,14,25H2,1-2H3
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PubMed
n/an/a>9.00E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (human))
BDBM36411
PNG
(2-((4-amino-3-(3-hydroxyphenyl)-1H-pyrazolo[3,4-d]...)
Show SMILES Cc1ccccc1-n1c(Cn2nc(-c3cccc(O)c3)c3c(N)ncnc23)nc2cccc(C)c2c1=O
Show InChI InChI=1S/C28H23N7O2/c1-16-7-3-4-12-21(16)35-22(32-20-11-5-8-17(2)23(20)28(35)37)14-34-27-24(26(29)30-15-31-27)25(33-34)18-9-6-10-19(36)13-18/h3-13,15,36H,14H2,1-2H3,(H2,29,30,31)
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PubMed
n/an/a>9.00E+4n/an/an/an/an/an/a



University of California, San Francisco



Assay Description
Biochemical assay using PI3Ks and diversification of tolyl quinazolinone series.


Chem Biol 17: 123-34 (2010)


Article DOI: 10.1016/j.chembiol.2010.01.010
BindingDB Entry DOI: 10.7270/Q2CR5RVT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%