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Compile Data Set for Download or QSAR

Found 690 hits Enz. Inhib. hit(s) with all data for entry = 6382   
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))
BDBM50396820
PNG
(CHEMBL2170088 | US8772480, 272)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C23H30FN9O3S/c1-13-12-32(37(5,34)35)6-7-33(13)14(2)16-8-18(21-28-15(3)29-23(25)31-21)20(26-10-16)30-17-9-19(24)22(36-4)27-11-17/h8-11,13-14H,6-7,12H2,1-5H3,(H,26,30)(H2,25,28,29,31)/t13-,14+/m0/s1
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1n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125327
PNG
(US8772480, 150)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cc1F
Show InChI InChI=1S/C24H24FN7O3S/c1-13(15-5-7-18(8-6-15)36(4,33)34)16-9-19(22-29-14(2)30-24(26)32-22)21(27-11-16)31-17-10-20(25)23(35-3)28-12-17/h5-13H,1-4H3,(H,27,31)(H2,26,29,30,32)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125451
PNG
(US8772480, 306)
Show SMILES COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C24H31FN8O3S/c1-14-13-32(37(5,34)35)6-7-33(14)15(2)17-8-19(21-10-22(26)30-16(3)29-21)23(27-11-17)31-18-9-20(25)24(36-4)28-12-18/h8-12,14-15H,6-7,13H2,1-5H3,(H,27,31)(H2,26,29,30)/t14-,15+/m0/s1
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1n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125442
PNG
(US8772480, 297)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C24H28FN9O3S/c1-14(33-5-7-34(8-6-33)38(4,35)36)16-9-18(20-21-23(29-13-28-21)31-15(2)30-20)22(26-11-16)32-17-10-19(25)24(37-3)27-12-17/h9-14H,5-8H2,1-4H3,(H,26,32)(H,28,29,30,31)/t14-/m1/s1
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1n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125323
PNG
(US8772480, 143)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
Show InChI InChI=1S/C22H28FN9O3S/c1-13(31-5-7-32(8-6-31)36(4,33)34)15-9-17(20-27-14(2)28-22(24)30-20)19(25-11-15)29-16-10-18(23)21(35-3)26-12-16/h9-13H,5-8H2,1-4H3,(H,25,29)(H2,24,27,28,30)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396807
PNG
(CHEMBL2170082 | US8772480, 316)
Show SMILES COc1ncc(Nc2ncc(CN3CCN(C[C@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
Show InChI InChI=1S/C22H28FN9O3S/c1-13-11-32(36(4,33)34)6-5-31(13)12-15-7-17(20-27-14(2)28-22(24)30-20)19(25-9-15)29-16-8-18(23)21(35-3)26-10-16/h7-10,13H,5-6,11-12H2,1-4H3,(H,25,29)(H2,24,27,28,30)/t13-/m1/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125496
PNG
(US8772480, 362)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cn1 |r|
Show InChI InChI=1S/C22H30N10O3S/c1-13-12-31(36(5,33)34)6-7-32(13)14(2)16-8-18(20-27-15(3)28-21(23)30-20)19(24-9-16)29-17-10-25-22(35-4)26-11-17/h8-11,13-14H,6-7,12H2,1-5H3,(H,24,29)(H2,23,27,28,30)/t13-,14+/m0/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401261
PNG
(CHEMBL2206921 | US8772480, 384)
Show SMILES CN(C)S(=O)(=O)Nc1cc(Nc2ncc(Cl)cc2-c2nc(C)nc(N)n2)cnc1Cl
Show InChI InChI=1S/C16H17Cl2N9O2S/c1-8-22-15(25-16(19)23-8)11-4-9(17)6-21-14(11)24-10-5-12(13(18)20-7-10)26-30(28,29)27(2)3/h4-7,26H,1-3H3,(H,21,24)(H2,19,22,23,25)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396806
PNG
(CHEMBL2170083 | US8772480, 270)
Show SMILES COc1ncc(Nc2ncc(CN3CCN(C[C@@H]3C)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
Show InChI InChI=1S/C22H28FN9O3S/c1-13-11-32(36(4,33)34)6-5-31(13)12-15-7-17(20-27-14(2)28-22(24)30-20)19(25-9-15)29-16-8-18(23)21(35-3)26-10-16/h7-10,13H,5-6,11-12H2,1-4H3,(H,25,29)(H2,24,27,28,30)/t13-/m0/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396818
PNG
(CHEMBL2170090 | US8772480, 280)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)N2CCN(CC2)S(C)(=O)=O)cc1F
Show InChI InChI=1S/C23H30FN9O3S/c1-14-28-20(31-22(25)29-14)17-10-15(23(2,3)32-6-8-33(9-7-32)37(5,34)35)12-26-19(17)30-16-11-18(24)21(36-4)27-13-16/h10-13H,6-9H2,1-5H3,(H,26,30)(H2,25,28,29,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125291
PNG
(US8772480, 103)
Show SMILES COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc3[nH]cnc23)cn1
Show InChI InChI=1S/C25H23N7O3S/c1-15-30-22(23-25(31-15)29-14-28-23)20-11-17(10-16-4-7-19(8-5-16)36(3,33)34)12-27-24(20)32-18-6-9-21(35-2)26-13-18/h4-9,11-14H,10H2,1-3H3,(H,27,32)(H,28,29,30,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125457
PNG
(US8772480, 312)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)CO)cc1F
Show InChI InChI=1S/C18H20FN7O2/c1-9(8-27)11-4-13(16-23-10(2)24-18(20)26-16)15(21-6-11)25-12-5-14(19)17(28-3)22-7-12/h4-7,9,27H,8H2,1-3H3,(H,21,25)(H2,20,23,24,26)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401253
PNG
(CHEMBL2206907 | US8772480, 328)
Show SMILES Cc1nc(N)nc(n1)-c1cc(cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1)C1CCOCC1
Show InChI InChI=1S/C20H23ClN8O3S/c1-11-25-19(28-20(22)26-11)15-7-13(12-3-5-32-6-4-12)9-24-18(15)27-14-8-16(17(21)23-10-14)29-33(2,30)31/h7-10,12,29H,3-6H2,1-2H3,(H,24,27)(H2,22,25,26,28)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50394838
PNG
(CHEMBL2165007 | US8772480, 141)
Show SMILES COc1ccc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
Show InChI InChI=1S/C23H23N7O3S/c1-14-27-22(30-23(24)28-14)19-11-16(10-15-4-7-18(8-5-15)34(3,31)32)12-26-21(19)29-17-6-9-20(33-2)25-13-17/h4-9,11-13H,10H2,1-3H3,(H,26,29)(H2,24,27,28,30)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125322
PNG
(US8772480, 142)
Show SMILES COc1ncc(Nc2ncc(Cc3ccc(cc3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F
Show InChI InChI=1S/C23H22FN7O3S/c1-13-28-21(31-23(25)29-13)18-9-15(8-14-4-6-17(7-5-14)35(3,32)33)11-26-20(18)30-16-10-19(24)22(34-2)27-12-16/h4-7,9-12H,8H2,1-3H3,(H,26,30)(H2,25,28,29,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125360
PNG
(US8772480, 190)
Show SMILES Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2ccccc2)nc1
Show InChI InChI=1S/C21H19N9O/c1-13-25-19(30-20(22)26-13)16-8-5-11-23-18(16)27-15-9-10-17(24-12-15)29-21(31)28-14-6-3-2-4-7-14/h2-12H,1H3,(H,23,27)(H2,22,25,26,30)(H2,24,28,29,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125450
PNG
(US8772480, 305)
Show SMILES COc1ncc(Nc2ncc(cc2-c2cc(N)nc(C)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C23H29FN8O3S/c1-14(31-5-7-32(8-6-31)36(4,33)34)16-9-18(20-11-21(25)29-15(2)28-20)22(26-12-16)30-17-10-19(24)23(35-3)27-13-17/h9-14H,5-8H2,1-4H3,(H,26,30)(H2,25,28,29)/t14-/m1/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396819
PNG
(CHEMBL2170089 | US8772480, 271)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C23H30FN9O3S/c1-13-12-32(37(5,34)35)6-7-33(13)14(2)16-8-18(21-28-15(3)29-23(25)31-21)20(26-10-16)30-17-9-19(24)22(36-4)27-11-17/h8-11,13-14H,6-7,12H2,1-5H3,(H,26,30)(H2,25,28,29,31)/t13-,14-/m0/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125429
PNG
(US8772480, 283)
Show SMILES COc1ncc(Nc2ncc(nc2-c2cc(N)nc(C)n2)C(C)N2CCN(CC2)S(C)(=O)=O)cc1F
Show InChI InChI=1S/C22H28FN9O3S/c1-13(31-5-7-32(8-6-31)36(4,33)34)18-12-25-21(29-15-9-16(23)22(35-3)26-11-15)20(30-18)17-10-19(24)28-14(2)27-17/h9-13H,5-8H2,1-4H3,(H,25,29)(H2,24,27,28)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125292
PNG
(US8772480, 104)
Show SMILES Cc1nc(-c2cc(Cc3ccc(cc3)S(C)(=O)=O)cnc2Nc2cccc3[nH]ncc23)c2nc[nH]c2n1
Show InChI InChI=1S/C26H22N8O2S/c1-15-31-23(24-26(32-15)29-14-28-24)19-11-17(10-16-6-8-18(9-7-16)37(2,35)36)12-27-25(19)33-21-4-3-5-22-20(21)13-30-34-22/h3-9,11-14H,10H2,1-2H3,(H,27,33)(H,30,34)(H,28,29,31,32)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125475
PNG
(US8772480, 339)
Show SMILES CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
Show InChI InChI=1S/C23H26ClN9O3S/c1-13(33-4-6-36-7-5-33)15-8-17(19-20-23(28-12-27-20)30-14(2)29-19)22(26-10-15)31-16-9-18(21(24)25-11-16)32-37(3,34)35/h8-13,32H,4-7H2,1-3H3,(H,26,31)(H,27,28,29,30)
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3n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125440
PNG
(US8772480, 295)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)[C@@H](C)N2CCN(C[C@@H]2C)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C25H30FN9O3S/c1-14-12-34(39(5,36)37)6-7-35(14)15(2)17-8-19(21-22-24(30-13-29-22)32-16(3)31-21)23(27-10-17)33-18-9-20(26)25(38-4)28-11-18/h8-11,13-15H,6-7,12H2,1-5H3,(H,27,33)(H,29,30,31,32)/t14-,15+/m0/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396809
PNG
(CHEMBL2170099 | US8772480, 147)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C22H28FN9O3S/c1-13(31-5-7-32(8-6-31)36(4,33)34)15-9-17(20-27-14(2)28-22(24)30-20)19(25-11-15)29-16-10-18(23)21(35-3)26-12-16/h9-13H,5-8H2,1-4H3,(H,25,29)(H2,24,27,28,30)/t13-/m0/s1
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4n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125361
PNG
(US8772480, 191)
Show SMILES Cc1nc(N)nc(n1)-c1cccnc1Nc1ccc(NC(=O)Nc2cccc(F)c2)nc1
Show InChI InChI=1S/C21H18FN9O/c1-12-26-19(31-20(23)27-12)16-6-3-9-24-18(16)28-15-7-8-17(25-11-15)30-21(32)29-14-5-2-4-13(22)10-14/h2-11H,1H3,(H,24,28)(H2,23,26,27,31)(H2,25,29,30,32)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125476
PNG
(US8772480, 340)
Show SMILES CC(N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc2[nH]cnc12 |w:1.0|
Show InChI InChI=1S/C24H29ClN10O3S/c1-14(35-5-7-38-8-6-35)16-9-18(20-21-24(29-13-28-21)31-15(2)30-20)23(27-11-16)32-17-10-19(22(25)26-12-17)33-39(36,37)34(3)4/h9-14,33H,5-8H2,1-4H3,(H,27,32)(H,28,29,30,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125395
PNG
(US8772480, 236)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(O)c2ccc(cc2)S(=O)(=O)N(C)C)cn1
Show InChI InChI=1S/C24H26N8O4S/c1-14-28-23(31-24(25)29-14)19-11-16(12-27-22(19)30-17-7-10-20(36-4)26-13-17)21(33)15-5-8-18(9-6-15)37(34,35)32(2)3/h5-13,21,33H,1-4H3,(H,27,30)(H2,25,28,29,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125422
PNG
(US8772480, 273)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)(C)O)cc1F
Show InChI InChI=1S/C18H20FN7O2/c1-9-23-15(26-17(20)24-9)12-5-10(18(2,3)27)7-21-14(12)25-11-6-13(19)16(28-4)22-8-11/h5-8,27H,1-4H3,(H,21,25)(H2,20,23,24,26)
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4n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125234
PNG
(US8772480, 36)
Show SMILES Cc1nc(N)nc(n1)-c1cc(CN2CCN(CC2)S(C)(=O)=O)cnc1Nc1cccc2[nH]ncc12
Show InChI InChI=1S/C22H26N10O2S/c1-14-26-21(29-22(23)27-14)16-10-15(13-31-6-8-32(9-7-31)35(2,33)34)11-24-20(16)28-18-4-3-5-19-17(18)12-25-30-19/h3-5,10-12H,6-9,13H2,1-2H3,(H,24,28)(H,25,30)(H2,23,26,27,29)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125410
PNG
(US8772480, 255)
Show SMILES COc1ncc(Nc2nc(ccc2-c2nc(C)nc(N)n2)-c2cccnc2)cc1F
Show InChI InChI=1S/C20H17FN8O/c1-11-25-17(29-20(22)26-11)14-5-6-16(12-4-3-7-23-9-12)28-18(14)27-13-8-15(21)19(30-2)24-10-13/h3-10H,1-2H3,(H,27,28)(H2,22,25,26,29)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125438
PNG
(US8772480, 293)
Show SMILES C[C@@H](N1CCN(C[C@@H]1C)S(C)(=O)=O)c1cnc(Nc2ccc3scnc3c2)c(c1)-c1nc(C)nc(N)n1 |r|
Show InChI InChI=1S/C24H29N9O2S2/c1-14-12-32(37(4,34)35)7-8-33(14)15(2)17-9-19(23-28-16(3)29-24(25)31-23)22(26-11-17)30-18-5-6-21-20(10-18)27-13-36-21/h5-6,9-11,13-15H,7-8,12H2,1-4H3,(H,26,30)(H2,25,28,29,31)/t14-,15+/m0/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401252
PNG
(CHEMBL2206908 | US8772480, 332)
Show SMILES Cc1nc(N)nc(n1)-c1cc(CN2CCOCC2)cnc1Nc1cnc(Cl)c(NS(C)(=O)=O)c1
Show InChI InChI=1S/C20H24ClN9O3S/c1-12-25-19(28-20(22)26-12)15-7-13(11-30-3-5-33-6-4-30)9-24-18(15)27-14-8-16(17(21)23-10-14)29-34(2,31)32/h7-10,29H,3-6,11H2,1-2H3,(H,24,27)(H2,22,25,26,28)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396808
PNG
(CHEMBL2170081 | US8772480, 148)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cc1F |r|
Show InChI InChI=1S/C22H28FN9O3S/c1-13(31-5-7-32(8-6-31)36(4,33)34)15-9-17(20-27-14(2)28-22(24)30-20)19(25-11-15)29-16-10-18(23)21(35-3)26-12-16/h9-13H,5-8H2,1-4H3,(H,25,29)(H2,24,27,28,30)/t13-/m1/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125443
PNG
(US8772480, 298)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2(O)CC2)cc1F
Show InChI InChI=1S/C18H18FN7O2/c1-9-23-15(26-17(20)24-9)12-5-10(18(27)3-4-18)7-21-14(12)25-11-6-13(19)16(28-2)22-8-11/h5-8,27H,3-4H2,1-2H3,(H,21,25)(H2,20,23,24,26)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125326
PNG
(US8772480, 149)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(C)c2ccc(cc2)S(C)(=O)=O)cn1
Show InChI InChI=1S/C24H25N7O3S/c1-14(16-5-8-19(9-6-16)35(4,32)33)17-11-20(23-28-15(2)29-24(25)31-23)22(27-12-17)30-18-7-10-21(34-3)26-13-18/h5-14H,1-4H3,(H,27,30)(H2,25,28,29,31)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125503
PNG
(US8772480, 372)
Show SMILES C[C@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1 |r|
Show InChI InChI=1S/C21H26ClN9O3S/c1-12(31-4-6-34-7-5-31)14-8-16(20-26-13(2)27-21(23)29-20)19(25-10-14)28-15-9-17(18(22)24-11-15)30-35(3,32)33/h8-12,30H,4-7H2,1-3H3,(H,25,28)(H2,23,26,27,29)/t12-/m0/s1
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401254
PNG
(CHEMBL2206906 | US8772480, 335)
Show SMILES COCCOc1cnc(Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c(c1)-c1nc(C)nc(N)n1
Show InChI InChI=1S/C18H21ClN8O4S/c1-10-23-17(26-18(20)24-10)13-7-12(31-5-4-30-2)9-22-16(13)25-11-6-14(15(19)21-8-11)27-32(3,28)29/h6-9,27H,4-5H2,1-3H3,(H,22,25)(H2,20,23,24,26)
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125474
PNG
(US8772480, 338)
Show SMILES Cc1nc(-c2cccnc2Nc2cnc(Cl)c(NS(C)(=O)=O)c2)c2nc[nH]c2n1
Show InChI InChI=1S/C17H15ClN8O2S/c1-9-23-13(14-17(24-9)22-8-21-14)11-4-3-5-19-16(11)25-10-6-12(15(18)20-7-10)26-29(2,27)28/h3-8,26H,1-2H3,(H,19,25)(H,21,22,23,24)
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125320
PNG
(US8772480, 139)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(O)c2ccc(cc2)S(C)(=O)=O)cn1
Show InChI InChI=1S/C25H23N7O4S/c1-14-30-21(22-25(31-14)29-13-28-22)19-10-16(23(33)15-4-7-18(8-5-15)37(3,34)35)11-27-24(19)32-17-6-9-20(36-2)26-12-17/h4-13,23,33H,1-3H3,(H,27,32)(H,28,29,30,31)
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50394860
PNG
(CHEMBL2165030 | US8772480, 256)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cn1 |t:23|
Show InChI InChI=1S/C20H21N7O2/c1-12-24-19(27-20(21)25-12)16-9-14(13-5-7-29-8-6-13)10-23-18(16)26-15-3-4-17(28-2)22-11-15/h3-5,9-11H,6-8H2,1-2H3,(H,23,26)(H2,21,24,25,27)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125498
PNG
(US8772480, 364)
Show SMILES COc1ncc(Nc2ncc(CN3CCN([C@H](C)C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cc1F |r|
Show InChI InChI=1S/C22H28FN9O3S/c1-13-11-31(5-6-32(13)36(4,33)34)12-15-7-17(20-27-14(2)28-22(24)30-20)19(25-9-15)29-16-8-18(23)21(35-3)26-10-16/h7-10,13H,5-6,11-12H2,1-4H3,(H,25,29)(H2,24,27,28,30)/t13-/m1/s1
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401270
PNG
(CHEMBL2206912 | US8772480, 264)
Show SMILES Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)c2ccc(F)cc2)c1
Show InChI InChI=1S/C20H16ClFN8O2S/c1-11-26-19(29-20(23)27-11)15-3-2-8-24-18(15)28-13-9-16(17(21)25-10-13)30-33(31,32)14-6-4-12(22)5-7-14/h2-10,30H,1H3,(H,24,28)(H2,23,26,27,29)
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Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125479
PNG
(US8772480, 343)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2=CCOCC2)cc1F |t:23|
Show InChI InChI=1S/C20H20FN7O2/c1-11-25-18(28-20(22)26-11)15-7-13(12-3-5-30-6-4-12)9-23-17(15)27-14-8-16(21)19(29-2)24-10-14/h3,7-10H,4-6H2,1-2H3,(H,23,27)(H2,22,25,26,28)
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125480
PNG
(US8772480, 344)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C2CCOCC2)cc1F
Show InChI InChI=1S/C20H22FN7O2/c1-11-25-18(28-20(22)26-11)15-7-13(12-3-5-30-6-4-12)9-23-17(15)27-14-8-16(21)19(29-2)24-10-14/h7-10,12H,3-6H2,1-2H3,(H,23,27)(H2,22,25,26,28)
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5n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125321
PNG
(US8772480, 140)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc3[nH]cnc23)C(C)N2CCN(CC2)S(C)(=O)=O)cn1
Show InChI InChI=1S/C24H29N9O3S/c1-15(32-7-9-33(10-8-32)37(4,34)35)17-11-19(21-22-24(28-14-27-22)30-16(2)29-21)23(26-12-17)31-18-5-6-20(36-3)25-13-18/h5-6,11-15H,7-10H2,1-4H3,(H,26,31)(H,27,28,29,30)
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125350
PNG
(US8772480, 178)
Show SMILES COc1ccc(Nc2ncc(CN3CCN(CC3)S(C)(=O)=O)cc2-c2cc(N)nc(C)n2)cn1
Show InChI InChI=1S/C22H28N8O3S/c1-15-26-19(11-20(23)27-15)18-10-16(14-29-6-8-30(9-7-29)34(3,31)32)12-25-22(18)28-17-4-5-21(33-2)24-13-17/h4-5,10-13H,6-9,14H2,1-3H3,(H,25,28)(H2,23,26,27)
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50401268
PNG
(CHEMBL2206914 | US8772480, 365)
Show SMILES Cc1nc(N)nc(n1)-c1cccnc1Nc1cnc(Cl)c(NS(=O)(=O)C2CC2)c1
Show InChI InChI=1S/C17H17ClN8O2S/c1-9-22-16(25-17(19)23-9)12-3-2-6-20-15(12)24-10-7-13(14(18)21-8-10)26-29(27,28)11-4-5-11/h2-3,6-8,11,26H,4-5H2,1H3,(H,20,24)(H2,19,22,23,25)
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125504
PNG
(US8772480, 373)
Show SMILES C[C@@H](N1CCOCC1)c1cnc(Nc2cnc(Cl)c(NS(=O)(=O)N(C)C)c2)c(c1)-c1nc(C)nc(N)n1 |r|
Show InChI InChI=1S/C22H29ClN10O3S/c1-13(33-5-7-36-8-6-33)15-9-17(21-27-14(2)28-22(24)30-21)20(26-11-15)29-16-10-18(19(23)25-12-16)31-37(34,35)32(3)4/h9-13,31H,5-8H2,1-4H3,(H,26,29)(H2,24,27,28,30)/t13-/m1/s1
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125386
PNG
(US8772480, 223)
Show SMILES COc1ccc(Nc2ncc(CN3CC(C3)S(C)(=O)=O)cc2-c2nc(C)nc(N)n2)cn1
Show InChI InChI=1S/C20H24N8O3S/c1-12-24-19(27-20(21)25-12)16-6-13(9-28-10-15(11-28)32(3,29)30)7-23-18(16)26-14-4-5-17(31-2)22-8-14/h4-8,15H,9-11H2,1-3H3,(H,23,26)(H2,21,24,25,27)
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125469
PNG
(US8772480, 325)
Show SMILES COc1ncc(Nc2ncc(cc2-c2nc(C)nc(N)n2)C(N2CCN(CC2)S(C)(=O)=O)C(F)(F)F)cc1F
Show InChI InChI=1S/C22H25F4N9O3S/c1-12-30-19(33-21(27)31-12)15-8-13(10-28-18(15)32-14-9-16(23)20(38-2)29-11-14)17(22(24,25)26)34-4-6-35(7-5-34)39(3,36)37/h8-11,17H,4-7H2,1-3H3,(H,28,32)(H2,27,30,31,33)
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM125517
PNG
(US8772480, 146)
Show SMILES COc1ccc(Nc2ncc(cc2-c2nc(C)nc(N)n2)[C@@H](C)N2CCN(CC2)S(C)(=O)=O)cn1 |r|
Show InChI InChI=1S/C22H29N9O3S/c1-14(30-7-9-31(10-8-30)35(4,32)33)16-11-18(21-26-15(2)27-22(23)29-21)20(25-12-16)28-17-5-6-19(34-3)24-13-17/h5-6,11-14H,7-10H2,1-4H3,(H,25,28)(H2,23,26,27,29)/t14-/m1/s1
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6n/an/an/an/an/an/an/an/a



Amgen Inc.

US Patent


Assay Description
The PI3K AlphaScreen assay (PerkinElmer, Waltham, Mass.) measures the activity of a panel of four phosphoinositide 3-kinases: PI3Kalpha, PI3Kbeta, PI...


US Patent US8772480 (2014)


BindingDB Entry DOI: 10.7270/Q2V123FJ
More data for this
Ligand-Target Pair
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