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Compile Data Set for Download or QSAR

Found 1253 hits with Last Name = 'gonzalez lopez de turiso' and Initial = 'f'   
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))
BDBM50403100
PNG
(CHEMBL2216891 | US8765940, 4-(3,3-dimethyl-6-(4-mo...)
Show SMILES Cc1ccc(c(c1)-c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C)S(C)(=O)=O
Show InChI InChI=1S/C31H32F2N4O3S/c1-18-6-7-26(41(5,38)39)22(12-18)28-19(2)29(27-23(33)13-20(32)14-24(27)35-28)37-17-31(3,4)30-25(37)15-21(16-34-30)36-8-10-40-11-9-36/h6-7,12-16H,8-11,17H2,1-5H3
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1.05n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124797
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6'-(4-morph...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCC1=O
Show InChI InChI=1S/C28H29F2N5O3/c1-17-25(24-20(30)12-18(29)13-21(24)32-27(17)34-5-2-23(34)36)35-16-28(3-8-37-9-4-28)26-22(35)14-19(15-31-26)33-6-10-38-11-7-33/h12-15H,2-11,16H2,1H3
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1.27n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124781
PNG
(US8765940, 1-(7-fluoro-3-methyl-2-(2-pyridinyl)-4-...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC2(CCS(=O)(=O)CC2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C31H31FN4O3S/c1-21-29(26-4-2-3-11-33-26)34-27-18-22(32)5-7-24(27)30(21)36-20-31(9-16-40(37,38)17-10-31)25-8-6-23(19-28(25)36)35-12-14-39-15-13-35/h2-8,11,18-19H,9-10,12-17,20H2,1H3
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1.37n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124778
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6'-(4-m...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CC(C)(C)CCC1=O
Show InChI InChI=1S/C32H37F2N5O3/c1-20-28(27-23(34)14-21(33)15-24(27)36-30(20)39-18-31(2,3)5-4-26(39)40)38-19-32(6-10-41-11-7-32)29-25(38)16-22(17-35-29)37-8-12-42-13-9-37/h14-17H,4-13,18-19H2,1-3H3
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1.49n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124765
PNG
(US8765940, 1'-(5,7-difluoro-3-methyl-2-(5-meth...)
Show SMILES Cc1ccc(c(c1)-c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C)S(C)(=O)=O
Show InChI InChI=1S/C33H34F2N4O4S/c1-20-4-5-28(44(3,40)41)24(14-20)30-21(2)31(29-25(35)15-22(34)16-26(29)37-30)39-19-33(6-10-42-11-7-33)32-27(39)17-23(18-36-32)38-8-12-43-13-9-38/h4-5,14-18H,6-13,19H2,1-3H3
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1.51n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124764
PNG
(US8765940, 2-(2,2-dimethyl-4-morpholinyl)-4-(3,3-d...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCOC(C)(C)C1
Show InChI InChI=1S/C29H35F2N5O2/c1-18-25(36-16-28(2,3)26-23(36)14-20(15-32-26)34-6-9-37-10-7-34)24-21(31)12-19(30)13-22(24)33-27(18)35-8-11-38-29(4,5)17-35/h12-15H,6-11,16-17H2,1-5H3
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1.52n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124749
PNG
(US8765940, 1-(4-(3,3-dimethyl-6-(4-morpholinyl)-2,...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Show InChI InChI=1S/C27H29F2N5O2/c1-16-24(23-19(29)11-17(28)12-20(23)31-26(16)33-6-4-5-22(33)35)34-15-27(2,3)25-21(34)13-18(14-30-25)32-7-9-36-10-8-32/h11-14H,4-10,15H2,1-3H3
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1.54n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124759
PNG
(US8765940, 1-(7-fluoro-3-methyl-4-(6'-(4-morph...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
Show InChI InChI=1S/C30H34FN5O3/c1-20-27(23-6-5-21(31)16-24(23)33-29(20)35-9-3-2-4-26(35)37)36-19-30(7-12-38-13-8-30)28-25(36)17-22(18-32-28)34-10-14-39-15-11-34/h5-6,16-18H,2-4,7-15,19H2,1H3
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1.62n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124767
PNG
(US8765940, 1-(7-fluoro-3-methyl-2-(4-methyl-2-pyri...)
Show SMILES Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CCS(=O)(=O)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C27H26FN5O3S/c1-17-5-6-29-23(13-17)25-18(2)26(21-4-3-19(28)14-22(21)31-25)33-9-12-37(34,35)27-24(33)15-20(16-30-27)32-7-10-36-11-8-32/h3-6,13-16H,7-12H2,1-2H3
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1.96n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124766
PNG
(US8765940, 1-(7-fluoro-3-methyl-2-(2-pyridinyl)-4-...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CCS(=O)(=O)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C26H24FN5O3S/c1-17-24(21-4-2-3-7-28-21)30-22-14-18(27)5-6-20(22)25(17)32-10-13-36(33,34)26-23(32)15-19(16-29-26)31-8-11-35-12-9-31/h2-7,14-16H,8-13H2,1H3
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2.22n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124799
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Show InChI InChI=1S/C27H27FN6O/c1-17-23(18-11-19(28)14-29-13-18)32-26-21(5-4-6-30-26)24(17)34-16-27(2,3)25-22(34)12-20(15-31-25)33-7-9-35-10-8-33/h4-6,11-15H,7-10,16H2,1-3H3
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2.24n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124783
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2ncccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc(F)c1
Show InChI InChI=1S/C28H28FN5O/c1-18-24(19-6-4-7-20(29)14-19)32-27-22(8-5-9-30-27)25(18)34-17-28(2,3)26-23(34)15-21(16-31-26)33-10-12-35-13-11-33/h4-9,14-16H,10-13,17H2,1-3H3
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2.30n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124798
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6'-(4-morph...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CC(C)(C)CC1=O
Show InChI InChI=1S/C31H35F2N5O3/c1-19-27(26-22(33)12-20(32)13-23(26)35-29(19)38-17-30(2,3)15-25(38)39)37-18-31(4-8-40-9-5-31)28-24(37)14-21(16-34-28)36-6-10-41-11-7-36/h12-14,16H,4-11,15,17-18H2,1-3H3
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2.30n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124743
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES COc1cccc(Cc2nc3cc(F)cc(F)c3c(N3CC(C)(C)c4ncc(cc34)N3CCOCC3)c2C)c1
Show InChI InChI=1S/C31H32F2N4O2/c1-19-25(13-20-6-5-7-23(12-20)38-4)35-26-15-21(32)14-24(33)28(26)29(19)37-18-31(2,3)30-27(37)16-22(17-34-30)36-8-10-39-11-9-36/h5-7,12,14-17H,8-11,13,18H2,1-4H3
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2.34n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124758
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6'-(4-morph...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Show InChI InChI=1S/C29H31F2N5O3/c1-18-26(25-21(31)13-19(30)14-22(25)33-28(18)35-6-2-3-24(35)37)36-17-29(4-9-38-10-5-29)27-23(36)15-20(16-32-27)34-7-11-39-12-8-34/h13-16H,2-12,17H2,1H3
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2.36n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124775
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1ccnc(c1)-c1nc2ncccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C28H30N6O/c1-18-7-9-29-22(14-18)24-19(2)25(21-6-5-8-30-27(21)32-24)34-17-28(3,4)26-23(34)15-20(16-31-26)33-10-12-35-13-11-33/h5-9,14-16H,10-13,17H2,1-4H3
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2.36n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124676
PNG
(US8765940, 4-(1-(7-fluoro-3-methyl-2-(2-(methylsul...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1ccnc(N)n1)-c1ccccc1S(C)(=O)=O
Show InChI InChI=1S/C30H27FN6O2S/c1-17-26(21-7-5-6-8-25(21)40(4,38)39)35-23-14-19(31)9-10-20(23)27(17)37-16-30(2,3)28-24(37)13-18(15-34-28)22-11-12-33-29(32)36-22/h5-15H,16H2,1-4H3,(H2,32,33,36)
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2.44n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124734
PNG
(US8765940, 3-((4-(3,3-dimethyl-6-(4-morpholinyl)-2...)
Show SMILES Cc1c(Cc2cccc(c2)C#N)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Show InChI InChI=1S/C31H29F2N5O/c1-19-25(12-20-5-4-6-21(11-20)16-34)36-26-14-22(32)13-24(33)28(26)29(19)38-18-31(2,3)30-27(38)15-23(17-35-30)37-7-9-39-10-8-37/h4-6,11,13-15,17H,7-10,12,18H2,1-3H3
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2.68n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124757
PNG
(US8765940, 1'-(8-chloro-2,3-dimethyl-4-quinoli...)
Show SMILES Cc1nc2c(Cl)cccc2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C26H29ClN4O2/c1-17-18(2)29-23-20(4-3-5-21(23)27)24(17)31-16-26(6-10-32-11-7-26)25-22(31)14-19(15-28-25)30-8-12-33-13-9-30/h3-5,14-15H,6-13,16H2,1-2H3
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2.68n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124779
PNG
(US8765940, tert-butyl 4-(5,7-difluoro-3-methyl-4-(...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCN(CC1)C(=O)OC(C)(C)C
Show InChI InChI=1S/C34H42F2N6O4/c1-22-29(42-21-34(5-13-44-14-6-34)30-27(42)19-24(20-37-30)39-11-15-45-16-12-39)28-25(36)17-23(35)18-26(28)38-31(22)40-7-9-41(10-8-40)32(43)46-33(2,3)4/h17-20H,5-16,21H2,1-4H3
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2.70n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124731
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cccc2[nH]ccc12
Show InChI InChI=1S/C31H29F2N5O/c1-18-28(22-5-4-6-24-21(22)7-8-34-24)36-25-14-19(32)13-23(33)27(25)29(18)38-17-31(2,3)30-26(38)15-20(16-35-30)37-9-11-39-12-10-37/h4-8,13-16,34H,9-12,17H2,1-3H3
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2.77n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124732
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(Cc2cccc(F)c2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Show InChI InChI=1S/C30H29F3N4O/c1-18-24(12-19-5-4-6-20(31)11-19)35-25-14-21(32)13-23(33)27(25)28(18)37-17-30(2,3)29-26(37)15-22(16-34-29)36-7-9-38-10-8-36/h4-6,11,13-16H,7-10,12,17H2,1-3H3
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2.87n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124728
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)C(=C)c1ccccc1
Show InChI InChI=1S/C31H30F2N4O/c1-19(21-8-6-5-7-9-21)28-20(2)29(27-24(33)14-22(32)15-25(27)35-28)37-18-31(3,4)30-26(37)16-23(17-34-30)36-10-12-38-13-11-36/h5-9,14-17H,1,10-13,18H2,2-4H3
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2.90n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124747
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1cncc(c1)-c1nc2cc(F)cc(F)c2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C29H29F2N5O/c1-17-9-19(14-32-13-17)26-18(2)27(25-22(31)10-20(30)11-23(25)34-26)36-16-29(3,4)28-24(36)12-21(15-33-28)35-5-7-37-8-6-35/h9-15H,5-8,16H2,1-4H3
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3n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124777
PNG
(US8765940, methyl 4-(5,7-difluoro-3-methyl-4-(6...)
Show SMILES COC(=O)N1CCN(CC1)c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C31H36F2N6O4/c1-20-27(26-23(33)15-21(32)16-24(26)35-29(20)37-5-7-38(8-6-37)30(40)41-2)39-19-31(3-11-42-12-4-31)28-25(39)17-22(18-34-28)36-9-13-43-14-10-36/h15-18H,3-14,19H2,1-2H3
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3.11n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124742
PNG
(US8765940, 1-(4-(3,3-dimethyl-6-(4-morpholinyl)-2,...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
Show InChI InChI=1S/C28H31F2N5O2/c1-17-25(24-20(30)12-18(29)13-21(24)32-27(17)34-7-5-4-6-23(34)36)35-16-28(2,3)26-22(35)14-19(15-31-26)33-8-10-37-11-9-33/h12-15H,4-11,16H2,1-3H3
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3.14n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124796
PNG
(US8765940, 4-(5,7-difluoro-3-methyl-4-(6'-(4-morph...)
Show SMILES CNC(=O)N1CCN(CC1)c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C31H37F2N7O3/c1-20-27(26-23(33)15-21(32)16-24(26)36-29(20)38-5-7-39(8-6-38)30(41)34-2)40-19-31(3-11-42-12-4-31)28-25(40)17-22(18-35-28)37-9-13-43-14-10-37/h15-18H,3-14,19H2,1-2H3,(H,34,41)
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3.16n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124727
PNG
(US8765940, 2-benzyl-4-(3,3-dimethyl-6-(4-morpholin...)
Show SMILES Cc1c(Cc2ccccc2)nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1
Show InChI InChI=1S/C30H30F2N4O/c1-19-24(13-20-7-5-4-6-8-20)34-25-15-21(31)14-23(32)27(25)28(19)36-18-30(2,3)29-26(36)16-22(17-33-29)35-9-11-37-12-10-35/h4-8,14-17H,9-13,18H2,1-3H3
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3.20n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396616
PNG
(CHEMBL2171930 | US8765940, 4-(1-(7-fluoro-3-methyl...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)-c1ccnc(N)n1)-c1ccccn1
Show InChI InChI=1S/C28H24FN7/c1-16-24(21-6-4-5-10-31-21)34-22-13-18(29)7-8-19(22)25(16)36-15-28(2,3)26-23(36)12-17(14-33-26)20-9-11-32-27(30)35-20/h4-14H,15H2,1-3H3,(H2,30,32,35)
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3.32n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124683
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cccc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C28H28FN5O/c1-18-25(22-8-4-5-10-30-22)32-21-9-6-7-20(29)24(21)26(18)34-17-28(2,3)27-23(34)15-19(16-31-27)33-11-13-35-14-12-33/h4-10,15-16H,11-14,17H2,1-3H3
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3.33n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124667
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1ncccc1-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C29H30FN5O/c1-18-26(22-6-5-9-31-19(22)2)33-24-14-20(30)7-8-23(24)27(18)35-17-29(3,4)28-25(35)15-21(16-32-28)34-10-12-36-13-11-34/h5-9,14-16H,10-13,17H2,1-4H3
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4.07n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124688
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1ccc(F)c2c(N3CC(C)(C)c4ncc(cc34)N3CCOCC3)c(C)c(nc12)-c1ccccn1
Show InChI InChI=1S/C29H30FN5O/c1-18-8-9-21(30)24-25(18)33-26(22-7-5-6-10-31-22)19(2)27(24)35-17-29(3,4)28-23(35)15-20(16-32-28)34-11-13-36-14-12-34/h5-10,15-16H,11-14,17H2,1-4H3
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4.07n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124741
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CC(C)(C)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C29H30FN5O/c1-18-7-8-31-24(13-18)26-19(2)27(22-6-5-20(30)14-23(22)33-26)35-17-29(3,4)28-25(35)15-21(16-32-28)34-9-11-36-12-10-34/h5-8,13-16H,9-12,17H2,1-4H3
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4.17n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124786
PNG
(US8765940, 1'-(3-methyl-2-phenyl-1,8-naphthyri...)
Show SMILES Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccc1
Show InChI InChI=1S/C30H31N5O2/c1-21-26(22-6-3-2-4-7-22)33-29-24(8-5-11-31-29)27(21)35-20-30(9-14-36-15-10-30)28-25(35)18-23(19-32-28)34-12-16-37-17-13-34/h2-8,11,18-19H,9-10,12-17,20H2,1H3
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4.36n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124675
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ccc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Show InChI InChI=1S/C31H32FN3O3S/c1-20-29(24-7-5-6-8-28(24)39(4,36)37)33-26-17-21(32)9-11-23(26)30(20)35-19-31(2,3)25-12-10-22(18-27(25)35)34-13-15-38-16-14-34/h5-12,17-18H,13-16,19H2,1-4H3
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4.43n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124755
PNG
(US8765940, 1'-(5,7-difluoro-3-methyl-2-(2-(met...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccc1S(C)(=O)=O
Show InChI InChI=1S/C32H32F2N4O4S/c1-20-29(23-5-3-4-6-27(23)43(2,39)40)36-25-16-21(33)15-24(34)28(25)30(20)38-19-32(7-11-41-12-8-32)31-26(38)17-22(18-35-31)37-9-13-42-14-10-37/h3-6,15-18H,7-14,19H2,1-2H3
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4.51n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124756
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6-(4-morpho...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ccc(cc12)N1CCOCC1)-n1ccccc1=O
Show InChI InChI=1S/C31H30F2N4O3/c1-20-29(28-24(33)16-21(32)17-25(28)34-30(20)36-9-3-2-4-27(36)38)37-19-31(7-12-39-13-8-31)23-6-5-22(18-26(23)37)35-10-14-40-15-11-35/h2-6,9,16-18H,7-8,10-15,19H2,1H3
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4.64n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124761
PNG
(US8765940, 1'-(7-fluoro-3-methyl-2-(4-methyl-2...)
Show SMILES Cc1ccnc(c1)-c1nc2cc(F)ccc2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C31H32FN5O2/c1-20-5-8-33-26(15-20)28-21(2)29(24-4-3-22(32)16-25(24)35-28)37-19-31(6-11-38-12-7-31)30-27(37)17-23(18-34-30)36-9-13-39-14-10-36/h3-5,8,15-18H,6-7,9-14,19H2,1-2H3
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5.19n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124746
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Show InChI InChI=1S/C28H26F3N5O/c1-16-25(17-8-19(30)13-32-12-17)34-22-10-18(29)9-21(31)24(22)26(16)36-15-28(2,3)27-23(36)11-20(14-33-27)35-4-6-37-7-5-35/h8-14H,4-7,15H2,1-3H3
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5.21n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124801
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES Cc1c(nc2cnccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1cncc(F)c1
Show InChI InChI=1S/C27H27FN6O/c1-17-24(18-10-19(28)13-30-12-18)32-22-15-29-5-4-21(22)25(17)34-16-27(2,3)26-23(34)11-20(14-31-26)33-6-8-35-9-7-33/h4-5,10-15H,6-9,16H2,1-3H3
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5.37n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124784
PNG
(US8765940, 1'-(2-(3-fluorophenyl)-3-methyl-1,8...)
Show SMILES Cc1c(nc2ncccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1cccc(F)c1
Show InChI InChI=1S/C30H30FN5O2/c1-20-26(21-4-2-5-22(31)16-21)34-29-24(6-3-9-32-29)27(20)36-19-30(7-12-37-13-8-30)28-25(36)17-23(18-33-28)35-10-14-38-15-11-35/h2-6,9,16-18H,7-8,10-15,19H2,1H3
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5.38n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124763
PNG
(US8765940, 1'-(2-(2,2-dimethyl-4-morpholinyl)-...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCOC(C)(C)C1
Show InChI InChI=1S/C31H37F2N5O3/c1-20-27(26-23(33)14-21(32)15-24(26)35-29(20)37-8-13-41-30(2,3)18-37)38-19-31(4-9-39-10-5-31)28-25(38)16-22(17-34-28)36-6-11-40-12-7-36/h14-17H,4-13,18-19H2,1-3H3
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5.40n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124751
PNG
(US8765940, 1-(5,7-difluoro-3-methyl-4-(6'-(4-m...)
Show SMILES Cc1c(nc2cc(F)cc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCCC1=O
Show InChI InChI=1S/C30H33F2N5O3/c1-19-27(26-22(32)14-20(31)15-23(26)34-29(19)36-7-3-2-4-25(36)38)37-18-30(5-10-39-11-6-30)28-24(37)16-21(17-33-28)35-8-12-40-13-9-35/h14-17H,2-13,18H2,1H3
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5.51n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124665
PNG
(US8765940, 4-(3,3-dimethyl-6-(4-morpholinyl)-2,3-d...)
Show SMILES CC(C)c1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C30H32FN5O/c1-19(2)26-27(23-7-5-6-10-32-23)34-24-15-20(31)8-9-22(24)28(26)36-18-30(3,4)29-25(36)16-21(17-33-29)35-11-13-37-14-12-35/h5-10,15-17,19H,11-14,18H2,1-4H3
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5.87n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124736
PNG
(US8765940, 4-(6-(3,6-dihydro-2H-pyran-4-yl)-3,3-di...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)C1=CCOCC1)-c1ccccn1 |t:27|
Show InChI InChI=1S/C29H27FN4O/c1-18-26(23-6-4-5-11-31-23)33-24-15-21(30)7-8-22(24)27(18)34-17-29(2,3)28-25(34)14-20(16-32-28)19-9-12-35-13-10-19/h4-9,11,14-16H,10,12-13,17H2,1-3H3
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6.47n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124753
PNG
(US8765940, 1'-(5-fluoro-3-methyl-2-(2-pyridiny...)
Show SMILES Cc1c(nc2cccc(F)c2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C30H30FN5O2/c1-20-27(24-6-2-3-10-32-24)34-23-7-4-5-22(31)26(23)28(20)36-19-30(8-13-37-14-9-30)29-25(36)17-21(18-33-29)35-11-15-38-16-12-35/h2-7,10,17-18H,8-9,11-16,19H2,1H3
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6.48n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396610
PNG
(CHEMBL2171929 | US8765940, 4-(3,3-dimethyl-6-(4-mo...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC(C)(C)c2ncc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C28H28FN5O/c1-18-25(22-6-4-5-9-30-22)32-23-14-19(29)7-8-21(23)26(18)34-17-28(2,3)27-24(34)15-20(16-31-27)33-10-12-35-13-11-33/h4-9,14-16H,10-13,17H2,1-3H3
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6.76n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124762
PNG
(US8765940, 1'-(5,7-difluoro-2-(2-methoxy-4-pyr...)
Show SMILES COc1cc(ccn1)-c1nc2cc(F)cc(F)c2c(N2CC3(CCOCC3)c3ncc(cc23)N2CCOCC2)c1C
Show InChI InChI=1S/C31H31F2N5O3/c1-19-28(20-3-6-34-26(13-20)39-2)36-24-15-21(32)14-23(33)27(24)29(19)38-18-31(4-9-40-10-5-31)30-25(38)16-22(17-35-30)37-7-11-41-12-8-37/h3,6,13-17H,4-5,7-12,18H2,1-2H3
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6.89n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM124769
PNG
(US8765940, 1-(7-fluoro-3-methyl-4-(6'-(4-morpholin...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC2(CCOCC2)c2ncc(cc12)N1CCOCC1)N1CCCC1=O
Show InChI InChI=1S/C29H32FN5O3/c1-19-26(22-5-4-20(30)15-23(22)32-28(19)34-8-2-3-25(34)36)35-18-29(6-11-37-12-7-29)27-24(35)16-21(17-31-27)33-9-13-38-14-10-33/h4-5,15-17H,2-3,6-14,18H2,1H3
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7.64n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM50396613
PNG
(CHEMBL2171924 | US8765940, 1-(7-fluoro-3-methyl-2-...)
Show SMILES Cc1c(nc2cc(F)ccc2c1N1CC2(CS(=O)(=O)C2)c2ccc(cc12)N1CCOCC1)-c1ccccn1
Show InChI InChI=1S/C29H27FN4O3S/c1-19-27(24-4-2-3-9-31-24)32-25-14-20(30)5-7-22(25)28(19)34-16-29(17-38(35,36)18-29)23-8-6-21(15-26(23)34)33-10-12-37-13-11-33/h2-9,14-15H,10-13,16-18H2,1H3
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7.75n/an/an/an/an/an/a7.0n/a



Amgen Inc.

US Patent


Assay Description
A PI3K Alphascreen assay (PerkinElmer, Waltham, Mass.) was used to measure the activity of a panel of four phosphoinositide 3-kinases: PI3Kα, PI...


US Patent US8765940 (2014)


BindingDB Entry DOI: 10.7270/Q2WW7G94
More data for this
Ligand-Target Pair
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