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PubMed code 28017532

Compile data set for download or QSAR
Found 140 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 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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n/an/a 0.600n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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n/an/a 0.600n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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n/an/a 0.631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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n/an/a 0.631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 0.794n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 0.794n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 0.794n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3K subunit p110gamma assessed as formation of phosphatidylinositide-3-phosphate product formation after 30 mins by fluorescence polar...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 0.800n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234159
PNG
(CHEMBL4099419)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cc(cn1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-15(21)18(25-14)29-11-12(9-24-29)16(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 2n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234154
PNG
(CHEMBL4100327)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H21N7/c1-31-23(24(11-12-24)15-7-3-2-4-8-15)29-22(30-31)19-14-27-21(25)20(28-19)17-13-26-18-10-6-5-9-16(17)18/h2-10,13-14,26H,11-12H2,1H3,(H2,25,27)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234150
PNG
(CHEMBL4061634)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C22H19N9/c1-30-21(22(11-12-22)14-7-3-2-4-8-14)26-19(28-30)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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n/an/a 3.16n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234150
PNG
(CHEMBL4061634)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C22H19N9/c1-30-21(22(11-12-22)14-7-3-2-4-8-14)26-19(28-30)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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n/an/a 3.20n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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n/an/a 5n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234152
PNG
(CHEMBL4092139)
Show SMILES Cn1nc(nc1C1(Cc2ccccc2)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C23H21N9/c1-31-22(23(11-12-23)13-15-7-3-2-4-8-15)27-20(29-31)17-14-25-19(24)21(26-17)32-18-10-6-5-9-16(18)28-30-32/h2-10,14H,11-13H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234168
PNG
(CHEMBL4061055)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cnn(c1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-18(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-16(21)15(25-14)12-9-24-29(11-12)19(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 7.90n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234170
PNG
(CHEMBL4068963)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-n1nnc2ccccc12)C1(CC1)c1ccccc1
Show InChI InChI=1S/C22H19N9/c1-30-19(26-21(28-30)22(11-12-22)14-7-3-2-4-8-14)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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n/an/a 9n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234166
PNG
(CHEMBL4070762)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(N)nc1
Show InChI InChI=1S/C21H20N8/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,22,24)(H2,23,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234153
PNG
(CHEMBL4060598)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ncc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)16-8-3-2-4-9-16)28-20(29-30)17-14-25-19(24)21(27-17)31-18-10-6-5-7-15(18)13-26-31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234163
PNG
(CHEMBL4082434)
Show SMILES Cn1nc(nc1C(C)(C)C1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N9O/c1-21(2,13-8-10-31-11-9-13)20-25-18(27-29(20)3)15-12-23-17(22)19(24-15)30-16-7-5-4-6-14(16)26-28-30/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta-mediated AKT phosphorylation at ser473 residue in human JeKo1 cells preincubated for 60 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234171
PNG
(CHEMBL4090043)
Show SMILES Nc1ncc(nc1-n1nnc2ccccc12)-c1n[nH]c(n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H17N9/c22-17-19(30-16-9-5-4-8-14(16)26-29-30)24-15(12-23-17)18-25-20(28-27-18)21(10-11-21)13-6-2-1-3-7-13/h1-9,12H,10-11H2,(H2,22,23)(H,25,27,28)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234145
PNG
(CHEMBL4096090)
Show SMILES Cn1nc(nc1Cc1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H17N9/c1-28-17(11-13-7-3-2-4-8-13)24-19(26-28)15-12-22-18(21)20(23-15)29-16-10-6-5-9-14(16)25-27-29/h2-10,12H,11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234147
PNG
(CHEMBL4092724)
Show SMILES Cn1nc(nc1CC1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C19H21N9O/c1-27-16(10-12-6-8-29-9-7-12)23-18(25-27)14-11-21-17(20)19(22-14)28-15-5-3-2-4-13(15)24-26-28/h2-5,11-12H,6-10H2,1H3,(H2,20,21)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234146
PNG
(CHEMBL4064890)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(F)nc1
Show InChI InChI=1S/C21H18FN7/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,23,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234149
PNG
(CHEMBL4099886)
Show SMILES C[C@H](c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12)c1ccccc1 |r|
Show InChI InChI=1S/C21H19N9/c1-13(14-8-4-3-5-9-14)20-25-19(27-29(20)2)16-12-23-18(22)21(24-16)30-17-11-7-6-10-15(17)26-28-30/h3-13H,1-2H3,(H2,22,23)/t13-/m0/s1
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta-mediated AKT phosphorylation at ser473 residue in human JeKo1 cells preincubated for 60 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234172
PNG
(CHEMBL4088819)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cnc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)15-7-3-2-4-8-15)28-20(29-30)17-13-25-19(24)21(27-17)31-14-26-16-9-5-6-10-18(16)31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234167
PNG
(CHEMBL4062135)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cc[nH]n1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(8-9-19)12-5-3-2-4-6-12)24-17(26-27)14-11-21-16(20)15(23-14)13-7-10-22-25-13/h2-7,10-11H,8-9H2,1H3,(H2,20,21)(H,22,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234160
PNG
(CHEMBL4063902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ccc(n1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(8-9-20)12-5-3-2-4-6-12)25-17(27-28)14-11-23-15(21)18(24-14)29-10-7-13(26-29)16(22)30/h2-7,10-11H,8-9H2,1H3,(H2,21,23)(H2,22,30)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234164
PNG
(CHEMBL4100450)
Show SMILES Cn1nc(nc1CN1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C18H20N10O/c1-26-15(11-27-6-8-29-9-7-27)22-17(24-26)13-10-20-16(19)18(21-13)28-14-5-3-2-4-12(14)23-25-28/h2-5,10H,6-9,11H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234165
PNG
(CHEMBL4090281)
Show SMILES C[C@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m0/s1
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 90n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta-mediated AKT phosphorylation at ser473 residue in human JeKo1 cells preincubated for 60 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234173
PNG
(CHEMBL4062277)
Show SMILES C[C@@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m1/s1
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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n/an/a 110n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta-mediated AKT phosphorylation at ser473 residue in human JeKo1 cells preincubated for 60 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 120n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kdelta-mediated AKT phosphorylation at ser473 residue in human JeKo1 cells preincubated for 60 mins followed by anti-IgM stimulation...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234140
PNG
(CHEMBL4102352)
Show SMILES Cn1nc(nc1C1(CO)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O/c1-25-16(17(9-27)6-7-17)21-14(23-25)11-8-19-13(18)15(20-11)26-12-5-3-2-4-10(12)22-24-26/h2-5,8,27H,6-7,9H2,1H3,(H2,18,19)
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n/an/a 126n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234142
PNG
(CHEMBL4078043)
Show SMILES Cn1nc(nc1C1(CC1)N1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H22N10O/c1-28-19(20(6-7-20)29-8-10-31-11-9-29)24-17(26-28)14-12-22-16(21)18(23-14)30-15-5-3-2-4-13(15)25-27-30/h2-5,12H,6-11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1A


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 140n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human DYRK1A expressed in baculovirus expression system


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234148
PNG
(CHEMBL4064432)
Show SMILES CN1CCN(CC1)C1(CC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N11/c1-29-9-11-31(12-10-29)21(7-8-21)20-25-18(27-30(20)2)15-13-23-17(22)19(24-15)32-16-6-4-3-5-14(16)26-28-32/h3-6,13H,7-12H2,1-2H3,(H2,22,23)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234145
PNG
(CHEMBL4096090)
Show SMILES Cn1nc(nc1Cc1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H17N9/c1-28-17(11-13-7-3-2-4-8-13)24-19(26-28)15-12-22-18(21)20(23-15)29-16-10-6-5-9-14(16)25-27-29/h2-10,12H,11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234140
PNG
(CHEMBL4102352)
Show SMILES Cn1nc(nc1C1(CO)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O/c1-25-16(17(9-27)6-7-17)21-14(23-25)11-8-19-13(18)15(20-11)26-12-5-3-2-4-10(12)22-24-26/h2-5,8,27H,6-7,9H2,1H3,(H2,18,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234147
PNG
(CHEMBL4092724)
Show SMILES Cn1nc(nc1CC1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C19H21N9O/c1-27-16(10-12-6-8-29-9-7-12)23-18(25-27)14-11-21-17(20)19(22-14)28-15-5-3-2-4-13(15)24-26-28/h2-5,11-12H,6-10H2,1H3,(H2,20,21)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234154
PNG
(CHEMBL4100327)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H21N7/c1-31-23(24(11-12-24)15-7-3-2-4-8-15)29-22(30-31)19-14-27-21(25)20(28-19)17-13-26-18-10-6-5-9-16(17)18/h2-10,13-14,26H,11-12H2,1H3,(H2,25,27)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234152
PNG
(CHEMBL4092139)
Show SMILES Cn1nc(nc1C1(Cc2ccccc2)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C23H21N9/c1-31-22(23(11-12-23)13-15-7-3-2-4-8-15)27-20(29-31)17-14-25-19(24)21(26-17)32-18-10-6-5-9-16(18)28-30-32/h2-10,14H,11-13H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234164
PNG
(CHEMBL4100450)
Show SMILES Cn1nc(nc1CN1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C18H20N10O/c1-26-15(11-27-6-8-29-9-7-27)22-17(24-26)13-10-20-16(19)18(21-13)28-14-5-3-2-4-12(14)23-25-28/h2-5,10H,6-9,11H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234150
PNG
(CHEMBL4061634)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C22H19N9/c1-30-21(22(11-12-22)14-7-3-2-4-8-14)26-19(28-30)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Endothelin-converting enzyme 1


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a>300n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of N-terminal His-tagged truncated recombinant human ECE1 expressed in mammalian expression system


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234151
PNG
(CHEMBL4084383)
Show SMILES Cn1nc(nc1C1(CC1)S(C)(=O)=O)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O2S/c1-25-16(17(7-8-17)29(2,27)28)21-14(23-25)11-9-19-13(18)15(20-11)26-12-6-4-3-5-10(12)22-24-26/h3-6,9H,7-8H2,1-2H3,(H2,18,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234163
PNG
(CHEMBL4082434)
Show SMILES Cn1nc(nc1C(C)(C)C1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N9O/c1-21(2,13-8-10-31-11-9-13)20-25-18(27-29(20)3)15-12-23-17(22)19(24-15)30-16-7-5-4-6-14(16)26-28-30/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23)
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n/an/a 316n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234156
PNG
(CHEMBL4092591)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)C#N
Show InChI InChI=1S/C17H15N7/c1-24-16(17(7-8-17)11-5-3-2-4-6-11)22-15(23-24)13-10-20-14(19)12(9-18)21-13/h2-6,10H,7-8H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234147
PNG
(CHEMBL4092724)
Show SMILES Cn1nc(nc1CC1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C19H21N9O/c1-27-16(10-12-6-8-29-9-7-12)23-18(25-27)14-11-21-17(20)19(22-14)28-15-5-3-2-4-13(15)24-26-28/h2-5,11-12H,6-10H2,1H3,(H2,20,21)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234145
PNG
(CHEMBL4096090)
Show SMILES Cn1nc(nc1Cc1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H17N9/c1-28-17(11-13-7-3-2-4-8-13)24-19(26-28)15-12-22-18(21)20(23-15)29-16-10-6-5-9-14(16)25-27-29/h2-10,12H,11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Dual specificity tyrosine-phosphorylation-regulated kinase 1B


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 330n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human DYRK1B expressed in baculovirus expression system


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 398n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234152
PNG
(CHEMBL4092139)
Show SMILES Cn1nc(nc1C1(Cc2ccccc2)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C23H21N9/c1-31-22(23(11-12-23)13-15-7-3-2-4-8-15)27-20(29-31)17-14-25-19(24)21(26-17)32-18-10-6-5-9-16(18)28-30-32/h2-10,14H,11-13H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234163
PNG
(CHEMBL4082434)
Show SMILES Cn1nc(nc1C(C)(C)C1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N9O/c1-21(2,13-8-10-31-11-9-13)20-25-18(27-29(20)3)15-12-23-17(22)19(24-15)30-16-7-5-4-6-14(16)26-28-30/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234164
PNG
(CHEMBL4100450)
Show SMILES Cn1nc(nc1CN1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C18H20N10O/c1-26-15(11-27-6-8-29-9-7-27)22-17(24-26)13-10-20-16(19)18(21-13)28-14-5-3-2-4-12(14)23-25-28/h2-5,10H,6-9,11H2,1H3,(H2,19,20)
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n/an/a 398n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234154
PNG
(CHEMBL4100327)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H21N7/c1-31-23(24(11-12-24)15-7-3-2-4-8-15)29-22(30-31)19-14-27-21(25)20(28-19)17-13-26-18-10-6-5-9-16(17)18/h2-10,13-14,26H,11-12H2,1H3,(H2,25,27)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Casein kinase I isoform gamma-3


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of full length GST-tagged recombinant human CSNK1G3 expressed in baculovirus expression system


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234149
PNG
(CHEMBL4099886)
Show SMILES C[C@H](c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12)c1ccccc1 |r|
Show InChI InChI=1S/C21H19N9/c1-13(14-8-4-3-5-9-14)20-25-19(27-29(20)2)16-12-23-18(22)21(24-16)30-17-11-7-6-10-15(17)26-28-30/h3-13H,1-2H3,(H2,22,23)/t13-/m0/s1
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234151
PNG
(CHEMBL4084383)
Show SMILES Cn1nc(nc1C1(CC1)S(C)(=O)=O)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O2S/c1-25-16(17(7-8-17)29(2,27)28)21-14(23-25)11-9-19-13(18)15(20-11)26-12-6-4-3-5-10(12)22-24-26/h3-6,9H,7-8H2,1-2H3,(H2,18,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234149
PNG
(CHEMBL4099886)
Show SMILES C[C@H](c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12)c1ccccc1 |r|
Show InChI InChI=1S/C21H19N9/c1-13(14-8-4-3-5-9-14)20-25-19(27-29(20)2)16-12-23-18(22)21(24-16)30-17-11-7-6-10-15(17)26-28-30/h3-13H,1-2H3,(H2,22,23)/t13-/m0/s1
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234150
PNG
(CHEMBL4061634)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C22H19N9/c1-30-21(22(11-12-22)14-7-3-2-4-8-14)26-19(28-30)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234159
PNG
(CHEMBL4099419)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cc(cn1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-15(21)18(25-14)29-11-12(9-24-29)16(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234140
PNG
(CHEMBL4102352)
Show SMILES Cn1nc(nc1C1(CO)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O/c1-25-16(17(9-27)6-7-17)21-14(23-25)11-8-19-13(18)15(20-11)26-12-5-3-2-4-10(12)22-24-26/h2-5,8,27H,6-7,9H2,1H3,(H2,18,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
5-hydroxytryptamine receptor 1A


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 600n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of 5HT1A receptor (unknown origin)


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234145
PNG
(CHEMBL4096090)
Show SMILES Cn1nc(nc1Cc1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H17N9/c1-28-17(11-13-7-3-2-4-8-13)24-19(26-28)15-12-22-18(21)20(23-15)29-16-10-6-5-9-14(16)25-27-29/h2-10,12H,11H2,1H3,(H2,21,22)
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n/an/a 631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234164
PNG
(CHEMBL4100450)
Show SMILES Cn1nc(nc1CN1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C18H20N10O/c1-26-15(11-27-6-8-29-9-7-27)22-17(24-26)13-10-20-16(19)18(21-13)28-14-5-3-2-4-12(14)23-25-28/h2-5,10H,6-9,11H2,1H3,(H2,19,20)
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n/an/a 631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234151
PNG
(CHEMBL4084383)
Show SMILES Cn1nc(nc1C1(CC1)S(C)(=O)=O)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O2S/c1-25-16(17(7-8-17)29(2,27)28)21-14(23-25)11-9-19-13(18)15(20-11)26-12-6-4-3-5-10(12)22-24-26/h3-6,9H,7-8H2,1-2H3,(H2,18,19)
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n/an/a 631n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234147
PNG
(CHEMBL4092724)
Show SMILES Cn1nc(nc1CC1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C19H21N9O/c1-27-16(10-12-6-8-29-9-7-12)23-18(25-27)14-11-21-17(20)19(22-14)28-15-5-3-2-4-13(15)24-26-28/h2-5,11-12H,6-10H2,1H3,(H2,20,21)
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234142
PNG
(CHEMBL4078043)
Show SMILES Cn1nc(nc1C1(CC1)N1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H22N10O/c1-28-19(20(6-7-20)29-8-10-31-11-9-29)24-17(26-28)14-12-22-16(21)18(23-14)30-15-5-3-2-4-13(15)25-27-30/h2-5,12H,6-11H2,1H3,(H2,21,22)
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n/an/a 794n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234173
PNG
(CHEMBL4062277)
Show SMILES C[C@@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m1/s1
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234159
PNG
(CHEMBL4099419)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cc(cn1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-15(21)18(25-14)29-11-12(9-24-29)16(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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n/an/a 1.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234173
PNG
(CHEMBL4062277)
Show SMILES C[C@@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m1/s1
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n/an/a<1.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234142
PNG
(CHEMBL4078043)
Show SMILES Cn1nc(nc1C1(CC1)N1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H22N10O/c1-28-19(20(6-7-20)29-8-10-31-11-9-29)24-17(26-28)14-12-22-16(21)18(23-14)30-15-5-3-2-4-13(15)25-27-30/h2-5,12H,6-11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234165
PNG
(CHEMBL4090281)
Show SMILES C[C@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m0/s1
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n/an/a 1.26E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234140
PNG
(CHEMBL4102352)
Show SMILES Cn1nc(nc1C1(CO)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O/c1-25-16(17(9-27)6-7-17)21-14(23-25)11-8-19-13(18)15(20-11)26-12-5-3-2-4-10(12)22-24-26/h2-5,8,27H,6-7,9H2,1H3,(H2,18,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234165
PNG
(CHEMBL4090281)
Show SMILES C[C@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m0/s1
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n/an/a 1.59E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234149
PNG
(CHEMBL4099886)
Show SMILES C[C@H](c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12)c1ccccc1 |r|
Show InChI InChI=1S/C21H19N9/c1-13(14-8-4-3-5-9-14)20-25-19(27-29(20)2)16-12-23-18(22)21(24-16)30-17-11-7-6-10-15(17)26-28-30/h3-13H,1-2H3,(H2,22,23)/t13-/m0/s1
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n/an/a 1.59E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234148
PNG
(CHEMBL4064432)
Show SMILES CN1CCN(CC1)C1(CC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N11/c1-29-9-11-31(12-10-29)21(7-8-21)20-25-18(27-30(20)2)15-13-23-17(22)19(24-15)32-16-6-4-3-5-14(16)26-28-32/h3-6,13H,7-12H2,1-2H3,(H2,22,23)
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n/an/a 2.00E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234153
PNG
(CHEMBL4060598)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ncc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)16-8-3-2-4-9-16)28-20(29-30)17-14-25-19(24)21(27-17)31-18-10-6-5-7-15(18)13-26-31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234152
PNG
(CHEMBL4092139)
Show SMILES Cn1nc(nc1C1(Cc2ccccc2)CC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C23H21N9/c1-31-22(23(11-12-23)13-15-7-3-2-4-8-15)27-20(29-31)17-14-25-19(24)21(26-17)32-18-10-6-5-9-16(18)28-30-32/h2-10,14H,11-13H2,1H3,(H2,24,25)
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n/an/a 2.51E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234141
PNG
(CHEMBL4083866)
Show SMILES Cc1n[nH]c(C)c1-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1 |(25.94,-39.46,;25.61,-37.95,;26.63,-36.8,;25.86,-35.48,;24.36,-35.81,;23.2,-34.79,;24.21,-37.34,;22.88,-38.12,;21.55,-37.36,;20.22,-38.13,;20.22,-39.67,;21.55,-40.44,;22.89,-39.67,;24.22,-40.44,;18.88,-37.35,;18.72,-35.82,;17.22,-35.5,;16.45,-36.83,;14.92,-36.99,;17.48,-37.98,;16.54,-34.1,;15.21,-34.87,;15.21,-33.33,;17.29,-32.76,;18.83,-32.73,;19.57,-31.39,;18.78,-30.06,;17.23,-30.1,;16.49,-31.45,)|
Show InChI InChI=1S/C21H22N8/c1-12-16(13(2)27-26-12)17-18(22)23-11-15(24-17)19-25-20(29(3)28-19)21(9-10-21)14-7-5-4-6-8-14/h4-8,11H,9-10H2,1-3H3,(H2,22,23)(H,26,27)
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234173
PNG
(CHEMBL4062277)
Show SMILES C[C@@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m1/s1
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n/an/a 3.16E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Mus musculus (Mouse))
BDBM50234157
PNG
(CHEMBL4089227)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C
Show InChI InChI=1S/C22H24N8O/c1-21(2,3)20-28-27-18(31-20)15-16(23)24-12-14(25-15)17-26-19(30(4)29-17)22(10-11-22)13-8-6-5-7-9-13/h5-9,12H,10-11H2,1-4H3,(H2,23,24)
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n/an/a 3.70E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma-mediated AKT phosphorylation at ser473 in mouse RAW246 cells preincubated for 3 hrs followed by C5a stimulation measured afte...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234165
PNG
(CHEMBL4090281)
Show SMILES C[C@H](N1CCOCC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12 |r|
Show InChI InChI=1S/C19H22N10O/c1-12(28-7-9-30-10-8-28)18-23-17(25-27(18)2)14-11-21-16(20)19(22-14)29-15-6-4-3-5-13(15)24-26-29/h3-6,11-12H,7-10H2,1-2H3,(H2,20,21)/t12-/m0/s1
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234154
PNG
(CHEMBL4100327)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1c[nH]c2ccccc12
Show InChI InChI=1S/C24H21N7/c1-31-23(24(11-12-24)15-7-3-2-4-8-15)29-22(30-31)19-14-27-21(25)20(28-19)17-13-26-18-10-6-5-9-16(17)18/h2-10,13-14,26H,11-12H2,1H3,(H2,25,27)
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234168
PNG
(CHEMBL4061055)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cnn(c1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-18(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-16(21)15(25-14)12-9-24-29(11-12)19(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234153
PNG
(CHEMBL4060598)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ncc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)16-8-3-2-4-9-16)28-20(29-30)17-14-25-19(24)21(27-17)31-18-10-6-5-7-15(18)13-26-31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234168
PNG
(CHEMBL4061055)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cnn(c1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-18(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-16(21)15(25-14)12-9-24-29(11-12)19(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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n/an/a 3.98E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234166
PNG
(CHEMBL4070762)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(N)nc1
Show InChI InChI=1S/C21H20N8/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,22,24)(H2,23,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234163
PNG
(CHEMBL4082434)
Show SMILES Cn1nc(nc1C(C)(C)C1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N9O/c1-21(2,13-8-10-31-11-9-13)20-25-18(27-29(20)3)15-12-23-17(22)19(24-15)30-16-7-5-4-6-14(16)26-28-30/h4-7,12-13H,8-11H2,1-3H3,(H2,22,23)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234166
PNG
(CHEMBL4070762)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(N)nc1
Show InChI InChI=1S/C21H20N8/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,22,24)(H2,23,25)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234150
PNG
(CHEMBL4061634)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C22H19N9/c1-30-21(22(11-12-22)14-7-3-2-4-8-14)26-19(28-30)16-13-24-18(23)20(25-16)31-17-10-6-5-9-15(17)27-29-31/h2-10,13H,11-12H2,1H3,(H2,23,24)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234160
PNG
(CHEMBL4063902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ccc(n1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(8-9-20)12-5-3-2-4-6-12)25-17(27-28)14-11-23-15(21)18(24-14)29-10-7-13(26-29)16(22)30/h2-7,10-11H,8-9H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234167
PNG
(CHEMBL4062135)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cc[nH]n1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(8-9-19)12-5-3-2-4-6-12)24-17(26-27)14-11-21-16(20)15(23-14)13-7-10-22-25-13/h2-7,10-11H,8-9H2,1H3,(H2,20,21)(H,22,25)
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n/an/a 6.31E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234172
PNG
(CHEMBL4088819)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cnc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)15-7-3-2-4-8-15)28-20(29-30)17-13-25-19(24)21(27-17)31-14-26-16-9-5-6-10-18(16)31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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n/an/a 7.94E+3n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Mus musculus (Mouse))
BDBM50234158
PNG
(CHEMBL4072500)
Show SMILES CN(C)S(=O)(=O)n1cc(cn1)-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1
Show InChI InChI=1S/C21H23N9O2S/c1-28(2)33(31,32)30-13-14(11-24-30)17-18(22)23-12-16(25-17)19-26-20(29(3)27-19)21(9-10-21)15-7-5-4-6-8-15/h4-8,11-13H,9-10H2,1-3H3,(H2,22,23)
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n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of PI3Kgamma-mediated AKT phosphorylation at ser473 in mouse RAW246 cells preincubated for 3 hrs followed by C5a stimulation measured afte...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234146
PNG
(CHEMBL4064890)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(F)nc1
Show InChI InChI=1S/C21H18FN7/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,23,25)
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234148
PNG
(CHEMBL4064432)
Show SMILES CN1CCN(CC1)C1(CC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N11/c1-29-9-11-31(12-10-29)21(7-8-21)20-25-18(27-30(20)2)15-13-23-17(22)19(24-15)32-16-6-4-3-5-14(16)26-28-32/h3-6,13H,7-12H2,1-2H3,(H2,22,23)
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234161
PNG
(CHEMBL4091680)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(cc1)C(N)=O
Show InChI InChI=1S/C23H21N7O/c1-30-22(23(11-12-23)16-5-3-2-4-6-16)28-21(29-30)17-13-26-19(24)18(27-17)14-7-9-15(10-8-14)20(25)31/h2-10,13H,11-12H2,1H3,(H2,24,26)(H2,25,31)
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n/an/a 1.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234172
PNG
(CHEMBL4088819)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cnc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)15-7-3-2-4-8-15)28-20(29-30)17-13-25-19(24)21(27-17)31-14-26-16-9-5-6-10-18(16)31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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n/an/a 1.26E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234159
PNG
(CHEMBL4099419)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cc(cn1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-15(21)18(25-14)29-11-12(9-24-29)16(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a 1.26E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234146
PNG
(CHEMBL4064890)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(F)nc1
Show InChI InChI=1S/C21H18FN7/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,23,25)
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n/an/a 1.58E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234143
PNG
(CHEMBL4091640)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cn[nH]c1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(7-8-19)13-5-3-2-4-6-13)25-17(26-27)14-11-21-16(20)15(24-14)12-9-22-23-10-12/h2-6,9-11H,7-8H2,1H3,(H2,20,21)(H,22,23)
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n/an/a 1.58E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234153
PNG
(CHEMBL4060598)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ncc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)16-8-3-2-4-9-16)28-20(29-30)17-14-25-19(24)21(27-17)31-18-10-6-5-7-15(18)13-26-31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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n/an/a>2.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234151
PNG
(CHEMBL4084383)
Show SMILES Cn1nc(nc1C1(CC1)S(C)(=O)=O)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C17H17N9O2S/c1-25-16(17(7-8-17)29(2,27)28)21-14(23-25)11-9-19-13(18)15(20-11)26-12-6-4-3-5-10(12)22-24-26/h3-6,9H,7-8H2,1-2H3,(H2,18,19)
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n/an/a 2.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234141
PNG
(CHEMBL4083866)
Show SMILES Cc1n[nH]c(C)c1-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1 |(25.94,-39.46,;25.61,-37.95,;26.63,-36.8,;25.86,-35.48,;24.36,-35.81,;23.2,-34.79,;24.21,-37.34,;22.88,-38.12,;21.55,-37.36,;20.22,-38.13,;20.22,-39.67,;21.55,-40.44,;22.89,-39.67,;24.22,-40.44,;18.88,-37.35,;18.72,-35.82,;17.22,-35.5,;16.45,-36.83,;14.92,-36.99,;17.48,-37.98,;16.54,-34.1,;15.21,-34.87,;15.21,-33.33,;17.29,-32.76,;18.83,-32.73,;19.57,-31.39,;18.78,-30.06,;17.23,-30.1,;16.49,-31.45,)|
Show InChI InChI=1S/C21H22N8/c1-12-16(13(2)27-26-12)17-18(22)23-11-15(24-17)19-25-20(29(3)28-19)21(9-10-21)14-7-5-4-6-8-14/h4-8,11H,9-10H2,1-3H3,(H2,22,23)(H,26,27)
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n/an/a<2.00E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234169
PNG
(CHEMBL4101902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(C(N)=O)c(F)c1
Show InChI InChI=1S/C23H20FN7O/c1-31-22(23(9-10-23)14-5-3-2-4-6-14)29-21(30-31)17-12-27-19(25)18(28-17)13-7-8-15(20(26)32)16(24)11-13/h2-8,11-12H,9-10H2,1H3,(H2,25,27)(H2,26,32)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM50234155
PNG
(CHEMBL4073489)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)cn1
Show InChI InChI=1S/C16H16N6/c1-22-15(16(7-8-16)11-5-3-2-4-6-11)20-14(21-22)12-9-19-13(17)10-18-12/h2-6,9-10H,7-8H2,1H3,(H2,17,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110delta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234142
PNG
(CHEMBL4078043)
Show SMILES Cn1nc(nc1C1(CC1)N1CCOCC1)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C20H22N10O/c1-28-19(20(6-7-20)29-8-10-31-11-9-29)24-17(26-28)14-12-22-16(21)18(23-14)30-15-5-3-2-4-13(15)25-27-30/h2-5,12H,6-11H2,1H3,(H2,21,22)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234167
PNG
(CHEMBL4062135)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cc[nH]n1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(8-9-19)12-5-3-2-4-6-12)24-17(26-27)14-11-21-16(20)15(23-14)13-7-10-22-25-13/h2-7,10-11H,8-9H2,1H3,(H2,20,21)(H,22,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234156
PNG
(CHEMBL4092591)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)C#N
Show InChI InChI=1S/C17H15N7/c1-24-16(17(7-8-17)11-5-3-2-4-6-11)22-15(23-24)13-10-20-14(19)12(9-18)21-13/h2-6,10H,7-8H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234166
PNG
(CHEMBL4070762)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(N)nc1
Show InChI InChI=1S/C21H20N8/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,22,24)(H2,23,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234160
PNG
(CHEMBL4063902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ccc(n1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(8-9-20)12-5-3-2-4-6-12)25-17(27-28)14-11-23-15(21)18(24-14)29-10-7-13(26-29)16(22)30/h2-7,10-11H,8-9H2,1H3,(H2,21,23)(H2,22,30)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234160
PNG
(CHEMBL4063902)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1ccc(n1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-19(20(8-9-20)12-5-3-2-4-6-12)25-17(27-28)14-11-23-15(21)18(24-14)29-10-7-13(26-29)16(22)30/h2-7,10-11H,8-9H2,1H3,(H2,21,23)(H2,22,30)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234141
PNG
(CHEMBL4083866)
Show SMILES Cc1n[nH]c(C)c1-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1 |(25.94,-39.46,;25.61,-37.95,;26.63,-36.8,;25.86,-35.48,;24.36,-35.81,;23.2,-34.79,;24.21,-37.34,;22.88,-38.12,;21.55,-37.36,;20.22,-38.13,;20.22,-39.67,;21.55,-40.44,;22.89,-39.67,;24.22,-40.44,;18.88,-37.35,;18.72,-35.82,;17.22,-35.5,;16.45,-36.83,;14.92,-36.99,;17.48,-37.98,;16.54,-34.1,;15.21,-34.87,;15.21,-33.33,;17.29,-32.76,;18.83,-32.73,;19.57,-31.39,;18.78,-30.06,;17.23,-30.1,;16.49,-31.45,)|
Show InChI InChI=1S/C21H22N8/c1-12-16(13(2)27-26-12)17-18(22)23-11-15(24-17)19-25-20(29(3)28-19)21(9-10-21)14-7-5-4-6-8-14/h4-8,11H,9-10H2,1-3H3,(H2,22,23)(H,26,27)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234155
PNG
(CHEMBL4073489)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)cn1
Show InChI InChI=1S/C16H16N6/c1-22-15(16(7-8-16)11-5-3-2-4-6-11)20-14(21-22)12-9-19-13(17)10-18-12/h2-6,9-10H,7-8H2,1H3,(H2,17,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform


(Homo sapiens (Human))
BDBM50234155
PNG
(CHEMBL4073489)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)cn1
Show InChI InChI=1S/C16H16N6/c1-22-15(16(7-8-16)11-5-3-2-4-6-11)20-14(21-22)12-9-19-13(17)10-18-12/h2-6,9-10H,7-8H2,1H3,(H2,17,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3Kgamma (144 to 1102 residues) using DiC8-PIP2 as substrate preincubated for 15 mins followed by substr...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234156
PNG
(CHEMBL4092591)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)C#N
Show InChI InChI=1S/C17H15N7/c1-24-16(17(7-8-17)11-5-3-2-4-6-11)22-15(23-24)13-10-20-14(19)12(9-18)21-13/h2-6,10H,7-8H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234141
PNG
(CHEMBL4083866)
Show SMILES Cc1n[nH]c(C)c1-c1nc(cnc1N)-c1nc(n(C)n1)C1(CC1)c1ccccc1 |(25.94,-39.46,;25.61,-37.95,;26.63,-36.8,;25.86,-35.48,;24.36,-35.81,;23.2,-34.79,;24.21,-37.34,;22.88,-38.12,;21.55,-37.36,;20.22,-38.13,;20.22,-39.67,;21.55,-40.44,;22.89,-39.67,;24.22,-40.44,;18.88,-37.35,;18.72,-35.82,;17.22,-35.5,;16.45,-36.83,;14.92,-36.99,;17.48,-37.98,;16.54,-34.1,;15.21,-34.87,;15.21,-33.33,;17.29,-32.76,;18.83,-32.73,;19.57,-31.39,;18.78,-30.06,;17.23,-30.1,;16.49,-31.45,)|
Show InChI InChI=1S/C21H22N8/c1-12-16(13(2)27-26-12)17-18(22)23-11-15(24-17)19-25-20(29(3)28-19)21(9-10-21)14-7-5-4-6-8-14/h4-8,11H,9-10H2,1-3H3,(H2,22,23)(H,26,27)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234172
PNG
(CHEMBL4088819)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-n1cnc2ccccc12
Show InChI InChI=1S/C23H20N8/c1-30-22(23(11-12-23)15-7-3-2-4-8-15)28-20(29-30)17-13-25-19(24)21(27-17)31-14-26-16-9-5-6-10-18(16)31/h2-10,13-14H,11-12H2,1H3,(H2,24,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234156
PNG
(CHEMBL4092591)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)C#N
Show InChI InChI=1S/C17H15N7/c1-24-16(17(7-8-17)11-5-3-2-4-6-11)22-15(23-24)13-10-20-14(19)12(9-18)21-13/h2-6,10H,7-8H2,1H3,(H2,19,20)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50234155
PNG
(CHEMBL4073489)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)cn1
Show InChI InChI=1S/C16H16N6/c1-22-15(16(7-8-16)11-5-3-2-4-6-11)20-14(21-22)12-9-19-13(17)10-18-12/h2-6,9-10H,7-8H2,1H3,(H2,17,19)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110alpha/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate addit...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234146
PNG
(CHEMBL4064890)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1ccc(F)nc1
Show InChI InChI=1S/C21H18FN7/c1-29-20(21(9-10-21)14-5-3-2-4-6-14)27-19(28-29)15-12-25-18(23)17(26-15)13-7-8-16(22)24-11-13/h2-8,11-12H,9-10H2,1H3,(H2,23,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234168
PNG
(CHEMBL4061055)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cnn(c1)C(N)=O
Show InChI InChI=1S/C20H19N9O/c1-28-18(20(7-8-20)13-5-3-2-4-6-13)26-17(27-28)14-10-23-16(21)15(25-14)12-9-24-29(11-12)19(22)30/h2-6,9-11H,7-8H2,1H3,(H2,21,23)(H2,22,30)
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n/an/a<3.16E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234167
PNG
(CHEMBL4062135)
Show SMILES Cn1nc(nc1C1(CC1)c1ccccc1)-c1cnc(N)c(n1)-c1cc[nH]n1
Show InChI InChI=1S/C19H18N8/c1-27-18(19(8-9-19)12-5-3-2-4-6-12)24-17(26-27)14-11-21-16(20)15(23-14)13-7-10-22-25-13/h2-7,10-11H,8-9H2,1H3,(H2,20,21)(H,22,25)
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AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50234148
PNG
(CHEMBL4064432)
Show SMILES CN1CCN(CC1)C1(CC1)c1nc(nn1C)-c1cnc(N)c(n1)-n1nnc2ccccc12
Show InChI InChI=1S/C21H25N11/c1-29-9-11-31(12-10-29)21(7-8-21)20-25-18(27-30(20)2)15-13-23-17(22)19(24-15)32-16-6-4-3-5-14(16)26-28-32/h3-6,13H,7-12H2,1-2H3,(H2,22,23)
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n/an/a<3.16E+4n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His6-tagged PI3K p110beta/p85alpha using DiC8-PIP2 as substrate preincubated for 15 mins followed by substrate additi...


Bioorg Med Chem Lett 27: 679-687 (2017)


Article DOI: 10.1016/j.bmcl.2016.11.004
BindingDB Entry DOI: 10.7270/Q2TF00MM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%