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USPatent US9156831

Compile data set for download or QSAR
Found 41 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185362
PNG
(US9156831, 3)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23,24)
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US Patent
n/an/a 7n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185362
PNG
(US9156831, 3)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23,24)
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US Patent
n/an/a<10n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185358
PNG
(US9156831, 9)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C22H29N9O4/c1-5-31-19(26-18(29-31)12-6-8-30(9-7-12)14(32)10-15(33)34)13-11-24-17(23)16(25-13)20-27-28-21(35-20)22(2,3)4/h11-12H,5-10H2,1-4H3,(H2,23,24)(H,33,34)
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n/an/a<10n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185358
PNG
(US9156831, 9)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C22H29N9O4/c1-5-31-19(26-18(29-31)12-6-8-30(9-7-12)14(32)10-15(33)34)13-11-24-17(23)16(25-13)20-27-28-21(35-20)22(2,3)4/h11-12H,5-10H2,1-4H3,(H2,23,24)(H,33,34)
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n/an/a<10n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185353
PNG
(US9156831, 4)
Show SMILES C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m1/s1
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US Patent
n/an/a<12n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185355
PNG
(US9156831, 6)
Show SMILES C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(11-32)20(33)31-8-6-13(7-9-31)17-26-18(30(5)29-17)14-10-24-16(23)15(25-14)19-27-28-21(34-19)22(2,3)4/h10,12-13,32H,6-9,11H2,1-5H3,(H2,23,24)/t12-/m1/s1
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US Patent
n/an/a<12n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185357
PNG
(US9156831, 8)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C21H27N9O4/c1-21(2,3)20-27-26-19(34-20)15-16(22)23-10-12(24-15)18-25-17(28-29(18)4)11-5-7-30(8-6-11)13(31)9-14(32)33/h10-11H,5-9H2,1-4H3,(H2,22,23)(H,32,33)
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US Patent
n/an/a 12n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185354
PNG
(US9156831, 5)
Show SMILES C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m0/s1
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US Patent
n/an/a 12n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185361
PNG
(US9156831, 1)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C21H29N9O3/c1-21(2,3)20-27-26-19(33-20)15-16(22)23-11-13(24-15)18-25-17(28-29(18)4)12-5-8-30(9-6-12)14(32)7-10-31/h11-12,31H,5-10H2,1-4H3,(H2,22,23)
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US Patent
n/an/a<14n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform


(Homo sapiens (Human))
BDBM185356
PNG
(US9156831, 7)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Show InChI InChI=1S/C22H31N9O3/c1-21(2,3)19-28-27-18(34-19)14-15(23)24-11-13(25-14)17-26-16(29-30(17)6)12-7-9-31(10-8-12)20(32)22(4,5)33/h11-12,33H,7-10H2,1-6H3,(H2,23,24)
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US Patent
n/an/a<14n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185361
PNG
(US9156831, 1)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C21H29N9O3/c1-21(2,3)20-27-26-19(33-20)15-16(22)23-11-13(24-15)18-25-17(28-29(18)4)12-5-8-30(9-6-12)14(32)7-10-31/h11-12,31H,5-10H2,1-4H3,(H2,22,23)
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US Patent
n/an/a 23n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185357
PNG
(US9156831, 8)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C21H27N9O4/c1-21(2,3)20-27-26-19(34-20)15-16(22)23-10-12(24-15)18-25-17(28-29(18)4)11-5-7-30(8-6-11)13(31)9-14(32)33/h10-11H,5-9H2,1-4H3,(H2,22,23)(H,32,33)
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US Patent
n/an/a 24n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185353
PNG
(US9156831, 4)
Show SMILES C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m1/s1
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US Patent
n/an/a 25n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185354
PNG
(US9156831, 5)
Show SMILES C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m0/s1
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US Patent
n/an/a 30n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185355
PNG
(US9156831, 6)
Show SMILES C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(11-32)20(33)31-8-6-13(7-9-31)17-26-18(30(5)29-17)14-10-24-16(23)15(25-14)19-27-28-21(34-19)22(2,3)4/h10,12-13,32H,6-9,11H2,1-5H3,(H2,23,24)/t12-/m1/s1
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US Patent
n/an/a 32n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM185356
PNG
(US9156831, 7)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Show InChI InChI=1S/C22H31N9O3/c1-21(2,3)19-28-27-18(34-19)14-15(23)24-11-13(25-14)17-26-16(29-30(17)6)12-7-9-31(10-8-12)20(32)22(4,5)33/h11-12,33H,7-10H2,1-6H3,(H2,23,24)
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US Patent
n/an/a 37n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185363
PNG
(US9156831, 10)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)[C@@H](O)CO
Show InChI InChI=1S/C22H31N9O4/c1-5-31-18(26-17(29-31)12-6-8-30(9-7-12)20(34)14(33)11-32)13-10-24-16(23)15(25-13)19-27-28-21(35-19)22(2,3)4/h10,12,14,32-33H,5-9,11H2,1-4H3,(H2,23,24)/t14-/m0/s1
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n/an/a 85n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185362
PNG
(US9156831, 3)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23,24)
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n/an/a 90n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185364
PNG
(US9156831, 11)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)[C@H](O)CO
Show InChI InChI=1S/C22H31N9O4/c1-5-31-18(26-17(29-31)12-6-8-30(9-7-12)20(34)14(33)11-32)13-10-24-16(23)15(25-13)19-27-28-21(35-19)22(2,3)4/h10,12,14,32-33H,5-9,11H2,1-4H3,(H2,23,24)/t14-/m1/s1
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n/an/a 110n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185354
PNG
(US9156831, 5)
Show SMILES C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m0/s1
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n/an/a 270n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185353
PNG
(US9156831, 4)
Show SMILES C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m1/s1
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n/an/a 310n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185358
PNG
(US9156831, 9)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C22H29N9O4/c1-5-31-19(26-18(29-31)12-6-8-30(9-7-12)14(32)10-15(33)34)13-11-24-17(23)16(25-13)20-27-28-21(35-20)22(2,3)4/h11-12H,5-10H2,1-4H3,(H2,23,24)(H,33,34)
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n/an/a 330n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185361
PNG
(US9156831, 1)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C21H29N9O3/c1-21(2,3)20-27-26-19(33-20)15-16(22)23-11-13(24-15)18-25-17(28-29(18)4)12-5-8-30(9-6-12)14(32)7-10-31/h11-12,31H,5-10H2,1-4H3,(H2,22,23)
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n/an/a 360n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185356
PNG
(US9156831, 7)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Show InChI InChI=1S/C22H31N9O3/c1-21(2,3)19-28-27-18(34-19)14-15(23)24-11-13(25-14)17-26-16(29-30(17)6)12-7-9-31(10-8-12)20(32)22(4,5)33/h11-12,33H,7-10H2,1-6H3,(H2,23,24)
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n/an/a 420n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185355
PNG
(US9156831, 6)
Show SMILES C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(11-32)20(33)31-8-6-13(7-9-31)17-26-18(30(5)29-17)14-10-24-16(23)15(25-14)19-27-28-21(34-19)22(2,3)4/h10,12-13,32H,6-9,11H2,1-5H3,(H2,23,24)/t12-/m1/s1
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n/an/a 530n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185362
PNG
(US9156831, 3)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23,24)
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n/an/a 570n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Mus musculus (Mouse))
BDBM185357
PNG
(US9156831, 8)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C21H27N9O4/c1-21(2,3)20-27-26-19(34-20)15-16(22)23-10-12(24-15)18-25-17(28-29(18)4)11-5-7-30(8-6-11)13(31)9-14(32)33/h10-11H,5-9H2,1-4H3,(H2,22,23)(H,32,33)
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n/an/a 590n/an/an/an/an/a37



AstraZeneca AB

US Patent


Assay Description
This assay was used to measure PI3K-alpha inhibition in cells. BT474 cells (human breast ductal carcinoma, ATCC HTB-20) were seeded into black 384 we...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185358
PNG
(US9156831, 9)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C22H29N9O4/c1-5-31-19(26-18(29-31)12-6-8-30(9-7-12)14(32)10-15(33)34)13-11-24-17(23)16(25-13)20-27-28-21(35-20)22(2,3)4/h11-12H,5-10H2,1-4H3,(H2,23,24)(H,33,34)
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n/an/a 640n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185357
PNG
(US9156831, 8)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C21H27N9O4/c1-21(2,3)20-27-26-19(34-20)15-16(22)23-10-12(24-15)18-25-17(28-29(18)4)11-5-7-30(8-6-11)13(31)9-14(32)33/h10-11H,5-9H2,1-4H3,(H2,22,23)(H,32,33)
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n/an/a 1.52E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185361
PNG
(US9156831, 1)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C21H29N9O3/c1-21(2,3)20-27-26-19(33-20)15-16(22)23-11-13(24-15)18-25-17(28-29(18)4)12-5-8-30(9-6-12)14(32)7-10-31/h11-12,31H,5-10H2,1-4H3,(H2,22,23)
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n/an/a 2.24E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185353
PNG
(US9156831, 4)
Show SMILES C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m1/s1
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n/an/a 2.91E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185354
PNG
(US9156831, 5)
Show SMILES C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m0/s1
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n/an/a 3.31E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185355
PNG
(US9156831, 6)
Show SMILES C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(11-32)20(33)31-8-6-13(7-9-31)17-26-18(30(5)29-17)14-10-24-16(23)15(25-14)19-27-28-21(34-19)22(2,3)4/h10,12-13,32H,6-9,11H2,1-5H3,(H2,23,24)/t12-/m1/s1
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n/an/a 3.42E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM185356
PNG
(US9156831, 7)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Show InChI InChI=1S/C22H31N9O3/c1-21(2,3)19-28-27-18(34-19)14-15(23)24-11-13(25-14)17-26-16(29-30(17)6)12-7-9-31(10-8-12)20(32)22(4,5)33/h11-12,33H,7-10H2,1-6H3,(H2,23,24)
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n/an/a 6.26E+3n/an/an/an/an/a25



AstraZeneca AB

US Patent


Assay Description
The inhibition of PI3K-beta, PI3K-alpha, PI3K-gamma and PI3K-delta was evaluated in a Kinase Glo based enzyme activity assay using human recombinant ...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185356
PNG
(US9156831, 7)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)C(C)(C)O
Show InChI InChI=1S/C22H31N9O3/c1-21(2,3)19-28-27-18(34-19)14-15(23)24-11-13(25-14)17-26-16(29-30(17)6)12-7-9-31(10-8-12)20(32)22(4,5)33/h11-12,33H,7-10H2,1-6H3,(H2,23,24)
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n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185353
PNG
(US9156831, 4)
Show SMILES C[C@@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m1/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185361
PNG
(US9156831, 1)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C21H29N9O3/c1-21(2,3)20-27-26-19(33-20)15-16(22)23-11-13(24-15)18-25-17(28-29(18)4)12-5-8-30(9-6-12)14(32)7-10-31/h11-12,31H,5-10H2,1-4H3,(H2,22,23)
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US Patent
n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185355
PNG
(US9156831, 6)
Show SMILES C[C@H](CO)C(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(11-32)20(33)31-8-6-13(7-9-31)17-26-18(30(5)29-17)14-10-24-16(23)15(25-14)19-27-28-21(34-19)22(2,3)4/h10,12-13,32H,6-9,11H2,1-5H3,(H2,23,24)/t12-/m1/s1
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US Patent
n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185362
PNG
(US9156831, 3)
Show SMILES CCn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CCO
Show InChI InChI=1S/C22H31N9O3/c1-5-31-19(26-18(29-31)13-6-9-30(10-7-13)15(33)8-11-32)14-12-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h12-13,32H,5-11H2,1-4H3,(H2,23,24)
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US Patent
n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185354
PNG
(US9156831, 5)
Show SMILES C[C@H](O)CC(=O)N1CCC(CC1)c1nc(-c2cnc(N)c(n2)-c2nnc(o2)C(C)(C)C)n(C)n1 |r|
Show InChI InChI=1S/C22H31N9O3/c1-12(32)10-15(33)31-8-6-13(7-9-31)18-26-19(30(5)29-18)14-11-24-17(23)16(25-14)20-27-28-21(34-20)22(2,3)4/h11-13,32H,6-10H2,1-5H3,(H2,23,24)/t12-/m0/s1
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n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ATR


(Homo sapiens (Human))
BDBM185357
PNG
(US9156831, 8)
Show SMILES Cn1nc(nc1-c1cnc(N)c(n1)-c1nnc(o1)C(C)(C)C)C1CCN(CC1)C(=O)CC(O)=O
Show InChI InChI=1S/C21H27N9O4/c1-21(2,3)20-27-26-19(34-20)15-16(22)23-10-12(24-15)18-25-17(28-29(18)4)11-5-7-30(8-6-11)13(31)9-14(32)33/h10-11H,5-9H2,1-4H3,(H2,22,23)(H,32,33)
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US Patent
n/an/a>3.00E+4n/an/an/an/an/an/a



AstraZeneca AB

US Patent


Assay Description
ATR (Ataxia Telangiectasia+Rad3-related kinase) is a PI3-kinase-related kinase which phosphorylates multiple substrates on serine or threonine residu...


US Patent US9156831 (2015)


BindingDB Entry DOI: 10.7270/Q2NV9H2N
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%