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Patent code US10918642

Compile Data Set for Download or QSAR
Found 68 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
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482217
PNG
(N-{3-[4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES CN1CCC(CC1)n1cc(-c2cccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C24H23Cl2FN6O2S/c1-32-9-7-14(8-10-32)33-12-17(21-23(28)29-13-30-24(21)33)16-3-2-4-20(22(16)27)31-36(34,35)15-5-6-18(25)19(26)11-15/h2-6,11-14,31H,7-10H2,1H3,(H2,28,29,30)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482201
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cc(F)c(Br)cc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H13BrF3N5O2S/c1-28-7-10(16-18(24)25-8-26-19(16)28)9-3-2-4-14(17(9)23)27-31(29,30)15-6-12(21)11(20)5-13(15)22/h2-8,27H,1H3,(H2,24,25,26)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482196
PNG
(N-{3-[4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C26H29FN6O3S/c1-16-13-18(7-8-22(16)36-3)37(34,35)31-21-6-4-5-19(24(21)27)20-14-33(17-9-11-32(2)12-10-17)26-23(20)25(28)29-15-30-26/h4-8,13-15,17,31H,9-12H2,1-3H3,(H2,28,29,30)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482193
PNG
(N-[3-(4-Amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C19H16ClFN6O3S/c1-27-19-15(18(22)23-9-24-19)17(25-27)11-4-3-5-13(16(11)21)26-31(28,29)10-6-7-14(30-2)12(20)8-10/h3-9,26H,1-2H3,(H2,22,23,24)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482167
PNG
(N-[3-(4-Amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C19H15ClF2N6O3S/c1-28-19-15(18(23)24-8-25-19)17(26-28)9-4-3-5-12(16(9)22)27-32(29,30)14-6-10(20)13(31-2)7-11(14)21/h3-8,27H,1-2H3,(H2,23,24,25)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482164
PNG
(N-{3-[4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C25H26ClFN6O3S/c1-32-10-8-15(9-11-32)33-13-18(22-24(28)29-14-30-25(22)33)17-4-3-5-20(23(17)27)31-37(34,35)16-6-7-21(36-2)19(26)12-16/h3-7,12-15,31H,8-11H2,1-2H3,(H2,28,29,30)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482207
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cc1cc(ccc1Br)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H17BrFN5O2S/c1-11-8-12(6-7-15(11)21)30(28,29)26-16-5-3-4-13(18(16)22)14-9-27(2)20-17(14)19(23)24-10-25-20/h3-10,26H,1-2H3,(H2,23,24,25)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482186
PNG
(2,3-Dihydro-benzofuran-5-sulfonic acid [3-(4-amino...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc4OCCc4c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C21H18FN5O3S/c1-27-10-15(18-20(23)24-11-25-21(18)27)14-3-2-4-16(19(14)22)26-31(28,29)13-5-6-17-12(9-13)7-8-30-17/h2-6,9-11,26H,7-8H2,1H3,(H2,23,24,25)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482219
PNG
(N-{3-[4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES COc1cc(F)c(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C26H28F2N6O3S/c1-15-11-22(19(27)12-21(15)37-3)38(35,36)32-20-6-4-5-17(24(20)28)18-13-34(16-7-9-33(2)10-8-16)26-23(18)25(29)30-14-31-26/h4-6,11-14,16,32H,7-10H2,1-3H3,(H2,29,30,31)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482183
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H16ClF2N5O3S/c1-28-8-11(17-19(24)25-9-26-20(17)28)10-4-3-5-14(18(10)23)27-32(29,30)16-6-12(21)15(31-2)7-13(16)22/h3-9,27H,1-2H3,(H2,24,25,26)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482171
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cccc(Cl)c3)c2Cl)c2c(N)ncnc12
Show InChI InChI=1S/C19H15Cl2N5O2S/c1-26-9-14(16-18(22)23-10-24-19(16)26)13-6-3-7-15(17(13)21)25-29(27,28)12-5-2-4-11(20)8-12/h2-10,25H,1H3,(H2,22,23,24)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482228
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1Br)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H17BrFN5O3S/c1-27-9-13(17-19(23)24-10-25-20(17)27)12-4-3-5-15(18(12)22)26-31(28,29)11-6-7-16(30-2)14(21)8-11/h3-10,26H,1-2H3,(H2,23,24,25)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482166
PNG
(N-{3-[4-Amino-7-(1-isopropyl-piperidin-4-yl)-7H-py...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(CC3)C(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C27H30ClFN6O3S/c1-16(2)34-11-9-17(10-12-34)35-14-20(24-26(30)31-15-32-27(24)35)19-5-4-6-22(25(19)29)33-39(36,37)18-7-8-23(38-3)21(28)13-18/h4-8,13-17,33H,9-12H2,1-3H3,(H2,30,31,32)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482200
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1cc(F)c(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C21H19F2N5O3S/c1-11-7-17(14(22)8-16(11)31-3)32(29,30)27-15-6-4-5-12(19(15)23)13-9-28(2)21-18(13)20(24)25-10-26-21/h4-10,27H,1-3H3,(H2,24,25,26)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482162
PNG
(N-[3-(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimid...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C22H21ClFN5O3S/c1-12(2)29-10-15(19-21(25)26-11-27-22(19)29)14-5-4-6-17(20(14)24)28-33(30,31)13-7-8-18(32-3)16(23)9-13/h4-12,28H,1-3H3,(H2,25,26,27)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482163
PNG
(N-[3-(4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C25H25ClF2N6O3S/c1-33-8-6-14(7-9-33)34-12-16(22-24(29)30-13-31-25(22)34)15-4-3-5-19(23(15)28)32-38(35,36)21-10-17(26)20(37-2)11-18(21)27/h3-5,10-14,32H,6-9H2,1-2H3,(H2,29,30,31)
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n/an/a<16n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482223
PNG
(5-Bromo-thiophene-2-sulfonic acid {3-[4-amino-7-(1...)
Show SMILES CN1CCC(CC1)n1cc(-c2cccc(NS(=O)(=O)c3ccc(Br)s3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C22H22BrFN6O2S2/c1-29-9-7-13(8-10-29)30-11-15(19-21(25)26-12-27-22(19)30)14-3-2-4-16(20(14)24)28-34(31,32)18-6-5-17(23)33-18/h2-6,11-13,28H,7-10H2,1H3,(H2,25,26,27)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482170
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C21H20FN5O3S/c1-12-9-13(7-8-17(12)30-3)31(28,29)26-16-6-4-5-14(19(16)22)15-10-27(2)21-18(15)20(23)24-11-25-21/h4-11,26H,1-3H3,(H2,23,24,25)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482177
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(cc3)[N+]([O-])=O)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H15FN6O4S/c1-25-9-14(16-18(21)22-10-23-19(16)25)13-3-2-4-15(17(13)20)24-31(29,30)12-7-5-11(6-8-12)26(27)28/h2-10,24H,1H3,(H2,21,22,23)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482198
PNG
(N-{3-[4-Amino-7-(1-isopropyl-piperidin-4-yl)-7H-py...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(CC3)C(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C28H33FN6O3S/c1-17(2)34-12-10-19(11-13-34)35-15-22(25-27(30)31-16-32-28(25)35)21-6-5-7-23(26(21)29)33-39(36,37)20-8-9-24(38-4)18(3)14-20/h5-9,14-17,19,33H,10-13H2,1-4H3,(H2,30,31,32)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482161
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H17ClFN5O3S/c1-27-9-13(17-19(23)24-10-25-20(17)27)12-4-3-5-15(18(12)22)26-31(28,29)11-6-7-16(30-2)14(21)8-11/h3-10,26H,1-2H3,(H2,23,24,25)
PDB

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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482188
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1c(C)cc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C22H22FN5O3S/c1-12-8-14(9-13(2)20(12)31-4)32(29,30)27-17-7-5-6-15(19(17)23)16-10-28(3)22-18(16)21(24)25-11-26-22/h5-11,27H,1-4H3,(H2,24,25,26)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482203
PNG
(5-Bromo-thiophene-2-sulfonic acid [3-(4-amino-7-me...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Br)s3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C17H13BrFN5O2S2/c1-24-7-10(14-16(20)21-8-22-17(14)24)9-3-2-4-11(15(9)19)23-28(25,26)13-6-5-12(18)27-13/h2-8,23H,1H3,(H2,20,21,22)
PDB

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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482226
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Cl)cc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14ClF2N5O2S/c1-27-8-12(16-18(23)24-9-25-19(16)27)11-3-2-4-14(17(11)22)26-30(28,29)15-6-5-10(20)7-13(15)21/h2-9,26H,1H3,(H2,23,24,25)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482227
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1C#N)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C21H17FN6O3S/c1-28-10-15(18-20(24)25-11-26-21(18)28)14-4-3-5-16(19(14)22)27-32(29,30)13-6-7-17(31-2)12(8-13)9-23/h3-8,10-11,27H,1-2H3,(H2,24,25,26)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482190
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cc(F)c(F)c(F)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H13F4N5O2S/c1-28-7-11(15-18(24)25-8-26-19(15)28)10-3-2-4-14(16(10)22)27-31(29,30)9-5-12(20)17(23)13(21)6-9/h2-8,27H,1H3,(H2,24,25,26)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482197
PNG
(N-{3-[4-Amino-7-(1-cyclopropyl-piperidin-4-yl)-7H-...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(CC3)C3CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C28H31FN6O3S/c1-17-14-20(8-9-24(17)38-2)39(36,37)33-23-5-3-4-21(26(23)29)22-15-35(28-25(22)27(30)31-16-32-28)19-10-12-34(13-11-19)18-6-7-18/h3-5,8-9,14-16,18-19,33H,6-7,10-13H2,1-2H3,(H2,30,31,32)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482181
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Br)cc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14BrF2N5O2S/c1-27-8-12(16-18(23)24-9-25-19(16)27)11-3-2-4-14(17(11)22)26-30(28,29)15-6-5-10(20)7-13(15)21/h2-9,26H,1H3,(H2,23,24,25)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482165
PNG
(N-{3-[4-Amino-7-(1-cyclopropyl-piperidin-4-yl)-7H-...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCN(CC3)C3CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C27H28ClFN6O3S/c1-38-23-8-7-18(13-21(23)28)39(36,37)33-22-4-2-3-19(25(22)29)20-14-35(27-24(20)26(30)31-15-32-27)17-9-11-34(12-10-17)16-5-6-16/h2-4,7-8,13-17,33H,5-6,9-12H2,1H3,(H2,30,31,32)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482206
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Br)c(c3)C(F)(F)F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C20H14BrF4N5O2S/c1-30-8-12(16-18(26)27-9-28-19(16)30)11-3-2-4-15(17(11)22)29-33(31,32)10-5-6-14(21)13(7-10)20(23,24)25/h2-9,29H,1H3,(H2,26,27,28)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482212
PNG
(N-[3-(4-Amino-1-piperidin-4-yl-1H-pyrazolo[3,4-d]p...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCNCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C23H23ClFN7O3S/c1-35-18-6-5-14(11-16(18)24)36(33,34)31-17-4-2-3-15(20(17)25)21-19-22(26)28-12-29-23(19)32(30-21)13-7-9-27-10-8-13/h2-6,11-13,27,31H,7-10H2,1H3,(H2,26,28,29)
PDB

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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482211
PNG
(N-[3-(4-Amino-1-piperidin-4-yl-1H-pyrazolo[3,4-d]p...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCNCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C23H22ClF2N7O3S/c1-36-17-10-15(25)18(9-14(17)24)37(34,35)32-16-4-2-3-13(20(16)26)21-19-22(27)29-11-30-23(19)33(31-21)12-5-7-28-8-6-12/h2-4,9-12,28,32H,5-8H2,1H3,(H2,27,29,30)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482221
PNG
(N-[3-(4-Amino-7-ethyl-7H-pyrrolo[2,3-d]pyrimidin-5...)
Show SMILES CCn1cc(-c2cccc(NS(=O)(=O)c3cc(Cl)c(OC)cc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C21H18ClF2N5O3S/c1-3-29-9-12(18-20(25)26-10-27-21(18)29)11-5-4-6-15(19(11)24)28-33(30,31)17-7-13(22)16(32-2)8-14(17)23/h4-10,28H,3H2,1-2H3,(H2,25,26,27)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482199
PNG
(N-{3-[4-Amino-7-(1-ethyl-piperidin-4-yl)-7H-pyrrol...)
Show SMILES CCN1CCC(CC1)n1cc(-c2cccc(NS(=O)(=O)c3ccc(OC)c(C)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C27H31FN6O3S/c1-4-33-12-10-18(11-13-33)34-15-21(24-26(29)30-16-31-27(24)34)20-6-5-7-22(25(20)28)32-38(35,36)19-8-9-23(37-3)17(2)14-19/h5-9,14-16,18,32H,4,10-13H2,1-3H3,(H2,29,30,31)
PDB

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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482194
PNG
(N-{3-[4-Amino-7-(tetrahydro-pyran-4-yl)-7H-pyrrolo...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCOCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C25H26FN5O4S/c1-15-12-17(6-7-21(15)34-2)36(32,33)30-20-5-3-4-18(23(20)26)19-13-31(16-8-10-35-11-9-16)25-22(19)24(27)28-14-29-25/h3-7,12-14,16,30H,8-11H2,1-2H3,(H2,27,28,29)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482184
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Cl)c(Cl)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14Cl2FN5O2S/c1-27-8-12(16-18(23)24-9-25-19(16)27)11-3-2-4-15(17(11)22)26-30(28,29)10-5-6-13(20)14(21)7-10/h2-9,26H,1H3,(H2,23,24,25)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482210
PNG
(N-{3-[4-Amino-1-(1-methyl-piperidin-4-yl)-1H-pyraz...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C24H24ClF2N7O3S/c1-33-8-6-13(7-9-33)34-24-20(23(28)29-12-30-24)22(31-34)14-4-3-5-17(21(14)27)32-38(35,36)19-10-15(25)18(37-2)11-16(19)26/h3-5,10-13,32H,6-9H2,1-2H3,(H2,28,29,30)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482224
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1cc(c(F)cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H16ClF2N5O3S/c1-28-8-11(17-19(24)25-9-26-20(17)28)10-4-3-5-14(18(10)23)27-32(29,30)16-7-15(31-2)12(21)6-13(16)22/h3-9,27H,1-2H3,(H2,24,25,26)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482218
PNG
(N-{3-[4-Amino-7-(1-methyl-piperidin-4-yl)-7H-pyrro...)
Show SMILES CN1CCC(CC1)n1cc(-c2cccc(NS(=O)(=O)c3ccc(Br)cc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C24H23BrF2N6O2S/c1-32-9-7-15(8-10-32)33-12-17(21-23(28)29-13-30-24(21)33)16-3-2-4-19(22(16)27)31-36(34,35)20-6-5-14(25)11-18(20)26/h2-6,11-13,15,31H,7-10H2,1H3,(H2,28,29,30)
PDB

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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482192
PNG
(N-[3-(4-Amino-1-methyl-1H-pyrazolo[3,4-d]pyrimidin...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2nn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H19FN6O3S/c1-11-9-12(7-8-15(11)30-3)31(28,29)26-14-6-4-5-13(17(14)21)18-16-19(22)23-10-24-20(16)27(2)25-18/h4-10,26H,1-3H3,(H2,22,23,24)
PDB

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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482191
PNG
(5-Bromo-6-chloro-pyridine-3-sulfonic acid [3-(4-am...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cnc(Cl)c(Br)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C18H13BrClFN6O2S/c1-27-7-11(14-17(22)24-8-25-18(14)27)10-3-2-4-13(15(10)21)26-30(28,29)9-5-12(19)16(20)23-6-9/h2-8,26H,1H3,(H2,22,24,25)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482213
PNG
(N-[3-(4-Amino-7-piperidin-4-yl-7H-pyrrolo[2,3-d]py...)
Show SMILES COc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C3CCNCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C25H27FN6O3S/c1-15-12-17(6-7-21(15)35-2)36(33,34)31-20-5-3-4-18(23(20)26)19-13-32(16-8-10-28-11-9-16)25-22(19)24(27)29-14-30-25/h3-7,12-14,16,28,31H,8-11H2,1-2H3,(H2,27,29,30)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482202
PNG
(5-Chloro-thiophene-2-sulfonic acid [3-(4-amino-7-m...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(Cl)s3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C17H13ClFN5O2S2/c1-24-7-10(14-16(20)21-8-22-17(14)24)9-3-2-4-11(15(9)19)23-28(25,26)13-6-5-12(18)27-13/h2-8,23H,1H3,(H2,20,21,22)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482195
PNG
(N-{3-[4-Amino-7-(tetrahydro-pyran-4-yl)-7H-pyrrolo...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCOCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C24H23ClFN5O4S/c1-34-20-6-5-15(11-18(20)25)36(32,33)30-19-4-2-3-16(22(19)26)17-12-31(14-7-9-35-10-8-14)24-21(17)23(27)28-13-29-24/h2-6,11-14,30H,7-10H2,1H3,(H2,27,28,29)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482185
PNG
(N-[2-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cc(Cl)cc(Cl)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14Cl2FN5O2S/c1-27-8-14(16-18(23)24-9-25-19(16)27)13-3-2-4-15(17(13)22)26-30(28,29)12-6-10(20)5-11(21)7-12/h2-9,26H,1H3,(H2,23,24,25)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482187
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES CCOc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C22H22FN5O3S/c1-4-31-18-9-8-14(10-13(18)2)32(29,30)27-17-7-5-6-15(20(17)23)16-11-28(3)22-19(16)21(24)25-12-26-22/h5-12,27H,4H2,1-3H3,(H2,24,25,26)
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n/an/a 33n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482220
PNG
(N-[3-(4-Amino-7-isopropyl-7H-pyrrolo[2,3-d]pyrimid...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C22H20ClF2N5O3S/c1-11(2)30-9-13(19-21(26)27-10-28-22(19)30)12-5-4-6-16(20(12)25)29-34(31,32)18-7-14(23)17(33-3)8-15(18)24/h4-11,29H,1-3H3,(H2,26,27,28)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482175
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C21H20FN5O4S/c1-27-10-14(18-20(23)24-11-25-21(18)27)13-5-4-6-15(19(13)22)26-32(28,29)12-7-8-16(30-2)17(9-12)31-3/h4-11,26H,1-3H3,(H2,23,24,25)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482230
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1C#N
Show InChI InChI=1S/C21H16ClFN6O3S/c1-29-9-13(19-20(25)26-10-27-21(19)29)11-4-3-5-16(12(11)8-24)28-33(30,31)18-6-14(22)17(32-2)7-15(18)23/h3-7,9-10,28H,1-2H3,(H2,25,26,27)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482215
PNG
(N-{3-[4-Amino-1-(1-methyl-piperidin-4-yl)-1H-pyraz...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCN(C)CC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C24H25ClFN7O3S/c1-32-10-8-14(9-11-32)33-24-20(23(27)28-13-29-24)22(30-33)16-4-3-5-18(21(16)26)31-37(34,35)15-6-7-19(36-2)17(25)12-15/h3-7,12-14,31H,8-11H2,1-2H3,(H2,27,28,29)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482225
PNG
(6-Methoxy-pyridine-3-sulfonic acid [3-(4-amino-7-m...)
Show SMILES COc1ccc(cn1)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C19H17FN6O3S/c1-26-9-13(16-18(21)23-10-24-19(16)26)12-4-3-5-14(17(12)20)25-30(27,28)11-6-7-15(29-2)22-8-11/h3-10,25H,1-2H3,(H2,21,23,24)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482173
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(cc3)C(F)(F)F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C20H15F4N5O2S/c1-29-9-14(16-18(25)26-10-27-19(16)29)13-3-2-4-15(17(13)21)28-32(30,31)12-7-5-11(6-8-12)20(22,23)24/h2-10,28H,1H3,(H2,25,26,27)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482176
PNG
(4-Methyl-3,4-dihydro-2H-benzo[1,4]oxazine-7-sulfon...)
Show SMILES CN1CCOc2cc(ccc12)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C22H21FN6O3S/c1-28-8-9-32-18-10-13(6-7-17(18)28)33(30,31)27-16-5-3-4-14(20(16)23)15-11-29(2)22-19(15)21(24)25-12-26-22/h3-7,10-12,27H,8-9H2,1-2H3,(H2,24,25,26)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482204
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cc(cc(c3)C(F)(F)F)C(F)(F)F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C21H14F7N5O2S/c1-33-8-14(16-18(29)30-9-31-19(16)33)13-3-2-4-15(17(13)22)32-36(34,35)12-6-10(20(23,24)25)5-11(7-12)21(26,27)28/h2-9,32H,1H3,(H2,29,30,31)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482214
PNG
(N-{3-[4-Amino-1-(1-isopropyl-piperidin-4-yl)-1H-py...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCN(CC3)C(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C26H28ClF2N7O3S/c1-14(2)35-9-7-15(8-10-35)36-26-22(25(30)31-13-32-26)24(33-36)16-5-4-6-19(23(16)29)34-40(37,38)21-11-17(27)20(39-3)12-18(21)28/h4-6,11-15,34H,7-10H2,1-3H3,(H2,30,31,32)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482222
PNG
(N-{3-[4-Amino-7-(tetrahydro-pyran-4-yl)-7H-pyrrolo...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2cn(C3CCOCC3)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C24H22ClF2N5O4S/c1-35-19-10-17(26)20(9-16(19)25)37(33,34)31-18-4-2-3-14(22(18)27)15-11-32(13-5-7-36-8-6-13)24-21(15)23(28)29-12-30-24/h2-4,9-13,31H,5-8H2,1H3,(H2,28,29,30)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482182
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3c(F)cccc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14F3N5O2S/c1-27-8-11(15-18(23)24-9-25-19(15)27)10-4-2-7-14(16(10)22)26-30(28,29)17-12(20)5-3-6-13(17)21/h2-9,26H,1H3,(H2,23,24,25)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482172
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H18FN5O3S/c1-26-10-15(17-19(22)23-11-24-20(17)26)14-4-3-5-16(18(14)21)25-30(27,28)13-8-6-12(29-2)7-9-13/h3-11,25H,1-2H3,(H2,22,23,24)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482208
PNG
(N-[3-(4-Amino-thieno[3,2-c]pyridin-3-yl)-2-fluoro-...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2csc3ccnc(N)c23)c1F
Show InChI InChI=1S/C20H14ClF2N3O3S2/c1-29-15-8-13(22)17(7-12(15)21)31(27,28)26-14-4-2-3-10(19(14)23)11-9-30-16-5-6-25-20(24)18(11)16/h2-9,26H,1H3,(H2,24,25)
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n/an/a 105n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482205
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(OC(F)(F)F)c(Cl)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C20H14ClF4N5O3S/c1-30-8-12(16-18(26)27-9-28-19(16)30)11-3-2-4-14(17(11)22)29-34(31,32)10-5-6-15(13(21)7-10)33-20(23,24)25/h2-9,29H,1H3,(H2,26,27,28)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482229
PNG
(Cyclohexanesulfonic acid [3-(4-amino-7-methyl-7H-p...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)C3CCCCC3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H22FN5O2S/c1-25-10-14(16-18(21)22-11-23-19(16)25)13-8-5-9-15(17(13)20)24-28(26,27)12-6-3-2-4-7-12/h5,8-12,24H,2-4,6-7H2,1H3,(H2,21,22,23)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482209
PNG
(N-[3-(4-Amino-thieno[3,2-c]pyridin-3-yl)-2-fluoro-...)
Show SMILES COc1cc(F)c(cc1C)S(=O)(=O)Nc1cccc(-c2csc3ncnc(N)c23)c1F
Show InChI InChI=1S/C20H16F2N4O3S2/c1-10-6-16(13(21)7-15(10)29-2)31(27,28)26-14-5-3-4-11(18(14)22)12-8-30-20-17(12)19(23)24-9-25-20/h3-9,26H,1-2H3,(H2,23,24,25)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482180
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3cc(F)ccc3F)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H14F3N5O2S/c1-27-8-12(16-18(23)24-9-25-19(16)27)11-3-2-4-14(17(11)22)26-30(28,29)15-7-10(20)5-6-13(15)21/h2-9,26H,1H3,(H2,23,24,25)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482189
PNG
(N-[3-(4-Amino-7-methyl-7H-pyrrolo[2,3-d]pyrimidin-...)
Show SMILES CC(C)Oc1ccc(cc1C)S(=O)(=O)Nc1cccc(-c2cn(C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C23H24FN5O3S/c1-13(2)32-19-9-8-15(10-14(19)3)33(30,31)28-18-7-5-6-16(21(18)24)17-11-29(4)23-20(17)22(25)26-12-27-23/h5-13,28H,1-4H3,(H2,25,26,27)
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n/an/a>160n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482168
PNG
(4-{4-Amino-3-[3-(5-chloro-2-fluoro-4-methoxy-benze...)
Show SMILES COc1cc(F)c(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCN(CC3)C(=O)OC(C)(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C28H30ClF2N7O5S/c1-28(2,3)43-27(39)37-10-8-15(9-11-37)38-26-22(25(32)33-14-34-26)24(35-38)16-6-5-7-19(23(16)31)36-44(40,41)21-12-17(29)20(42-4)13-18(21)30/h5-7,12-15,36H,8-11H2,1-4H3,(H2,32,33,34)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482179
PNG
(Naphthalene-2-sulfonic acid [3-(4-amino-7-methyl-7...)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc4ccccc4c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C23H18FN5O2S/c1-29-12-18(20-22(25)26-13-27-23(20)29)17-7-4-8-19(21(17)24)28-32(30,31)16-10-9-14-5-2-3-6-15(14)11-16/h2-13,28H,1H3,(H2,25,26,27)
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Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482169
PNG
(4-{4-Amino-3-[3-(3-chloro-4-methoxy-benzenesulfony...)
Show SMILES COc1ccc(cc1Cl)S(=O)(=O)Nc1cccc(-c2nn(C3CCN(CC3)C(=O)OC(C)(C)C)c3ncnc(N)c23)c1F
Show InChI InChI=1S/C28H31ClFN7O5S/c1-28(2,3)42-27(38)36-12-10-16(11-13-36)37-26-22(25(31)32-15-33-26)24(34-37)18-6-5-7-20(23(18)30)35-43(39,40)17-8-9-21(41-4)19(29)14-17/h5-9,14-16,35H,10-13H2,1-4H3,(H2,31,32,33)
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n/an/a>160n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Serially diluted compounds were incubated for 60 minutes at room temperature in the presence of ATP/P33 gammaATP mix, substrate and enzyme in a volum...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 2-alpha kinase 3


(Homo sapiens (Human))
BDBM482216
PNG
(US10918642, Cmpd # 67 | rrr)
Show SMILES Cn1cc(-c2cccc(NS(=O)(=O)c3ccc(O)c(Cl)c3)c2F)c2c(N)ncnc12
Show InChI InChI=1S/C19H15ClFN5O3S/c1-26-8-12(16-18(22)23-9-24-19(16)26)11-3-2-4-14(17(11)21)25-30(28,29)10-5-6-15(27)13(20)7-10/h2-9,25,27H,1H3,(H2,22,23,24)
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n/an/a>160n/an/an/an/an/an/a



Nerviano Medical Sciences S.R.L.

US Patent


Assay Description
Compounds were 3-fold serially diluted in order to obtain from 3.333 to 0.000169 microM final concentration, then incubated for 60 minutes at room te...


US Patent US10918642 (2021)

More data for this
Ligand-Target Pair
* indicates data uncertainty>20%