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Patent code US10266549

Compile Data Set for Download or QSAR

Found 345 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379450
PNG
(US10266549, Example 349)
Show SMILES COc1ccc(Nc2ncc(c(NC3CC3)n2)C(F)(F)F)cc1OC
Show InChI InChI=1S/C16H17F3N4O2/c1-24-12-6-5-10(7-13(12)25-2)22-15-20-8-11(16(17,18)19)14(23-15)21-9-3-4-9/h5-9H,3-4H2,1-2H3,(H2,20,21,22,23)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379164
PNG
((E)-6-(4-Styryl-5-(trifluoromethyl)pyrimidin-2-yla...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1\C=C\c1ccccc1
Show InChI InChI=1S/C22H17F3N4O/c23-22(24,25)17-13-26-21(29-19(17)9-6-14-4-2-1-3-5-14)27-16-8-10-18-15(12-16)7-11-20(30)28-18/h1-6,8-10,12-13H,7,11H2,(H,28,30)(H,26,27,29)/b9-6+
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US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379216
PNG
(US10266549, Example 124*)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1Nc1ccc2OCOc2c1
Show InChI InChI=1S/C21H16F3N5O3/c22-21(23,24)14-9-25-20(27-12-2-4-15-11(7-12)1-6-18(30)28-15)29-19(14)26-13-3-5-16-17(8-13)32-10-31-16/h2-5,7-9H,1,6,10H2,(H,28,30)(H2,25,26,27,29)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379218
PNG
(6-((4-((3,4-dimethylphenyl)amino)-5-(trifluorometh...)
Show SMILES Cc1ccc(Nc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2C(F)(F)F)cc1C
Show InChI InChI=1S/C22H20F3N5O/c1-12-3-5-15(9-13(12)2)27-20-17(22(23,24)25)11-26-21(30-20)28-16-6-7-18-14(10-16)4-8-19(31)29-18/h3,5-7,9-11H,4,8H2,1-2H3,(H,29,31)(H2,26,27,28,30)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379228
PNG
(N-(4-((2-((2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)a...)
Show SMILES CC(=O)Nc1ccc(Nc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2C(F)(F)F)cc1
Show InChI InChI=1S/C22H19F3N6O2/c1-12(32)27-14-3-5-15(6-4-14)28-20-17(22(23,24)25)11-26-21(31-20)29-16-7-8-18-13(10-16)2-9-19(33)30-18/h3-8,10-11H,2,9H2,1H3,(H,27,32)(H,30,33)(H2,26,28,29,31)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379249
PNG
(US10266549, Example 150b)
Show SMILES FC(F)(F)c1cnc(NC2CCC2)nc1Nc1ccc2NC(=O)CCc2c1
Show InChI InChI=1S/C18H18F3N5O/c19-18(20,21)13-9-22-17(24-11-2-1-3-11)26-16(13)23-12-5-6-14-10(8-12)4-7-15(27)25-14/h5-6,8-9,11H,1-4,7H2,(H,25,27)(H2,22,23,24,26)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379252
PNG
(US10266549, Example 152a)
Show SMILES FC(F)(F)c1cnc(Nc2cnc3[nH]ccc3c2)nc1NC1CC1
Show InChI InChI=1S/C15H13F3N6/c16-15(17,18)11-7-21-14(24-13(11)22-9-1-2-9)23-10-5-8-3-4-19-12(8)20-6-10/h3-7,9H,1-2H2,(H,19,20)(H2,21,22,23,24)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379293
PNG
(US10266549, Example 181a)
Show SMILES FC(F)(F)c1cnc(Nc2cnc3[nH]ccc3c2)nc1Nc1ccccc1
Show InChI InChI=1S/C18H13F3N6/c19-18(20,21)14-10-24-17(27-16(14)25-12-4-2-1-3-5-12)26-13-8-11-6-7-22-15(11)23-9-13/h1-10H,(H,22,23)(H2,24,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379308
PNG
(6-((5-bromo-2-((2,3-dihydrobenzo[b][1,4]dioxin-6-y...)
Show SMILES Brc1cnc(Nc2ccc3OCCOc3c2)nc1Nc1cnc2[nH]c(=O)oc2c1
Show InChI InChI=1S/C18H13BrN6O4/c19-11-8-21-17(23-9-1-2-12-13(5-9)28-4-3-27-12)24-15(11)22-10-6-14-16(20-7-10)25-18(26)29-14/h1-2,5-8H,3-4H2,(H,20,25,26)(H2,21,22,23,24)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379316
PNG
(6-((4-(2-ethylhydrazinyl)-5-(trifluoromethyl)pyrim...)
Show SMILES CCNNc1nc(Nc2ccc3NC(=O)CCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H17F3N6O/c1-2-21-25-14-11(16(17,18)19)8-20-15(24-14)22-10-4-5-12-9(7-10)3-6-13(26)23-12/h4-5,7-8,21H,2-3,6H2,1H3,(H,23,26)(H2,20,22,24,25)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379320
PNG
(N4-cyclopropyl-N2-(pyrimidin-5-yl)-5-(trifluoromet...)
Show SMILES FC(F)(F)c1cnc(Nc2cncnc2)nc1NC1CC1
Show InChI InChI=1S/C12H11F3N6/c13-12(14,15)9-5-18-11(20-8-3-16-6-17-4-8)21-10(9)19-7-1-2-7/h3-7H,1-2H2,(H2,18,19,20,21)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379341
PNG
(US10266549, Example 220b)
Show SMILES CN(C)c1nc(Nc2ccc3NC(=O)CCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C16H16F3N5O/c1-24(2)14-11(16(17,18)19)8-20-15(23-14)21-10-4-5-12-9(7-10)3-6-13(25)22-12/h4-5,7-8H,3,6H2,1-2H3,(H,22,25)(H,20,21,23)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379386
PNG
(5-bromo-4-(2-(methoxymethyl)phenoxy)-N-(3,4,5-trim...)
Show SMILES COCc1ccccc1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Br
Show InChI InChI=1S/C21H22BrN3O5/c1-26-12-13-7-5-6-8-16(13)30-20-15(22)11-23-21(25-20)24-14-9-17(27-2)19(29-4)18(10-14)28-3/h5-11H,12H2,1-4H3,(H,23,24,25)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379397
PNG
(5-bromo-N4-phenyl-N2-(3,4,5-trimethoxyphenyl)pyrim...)
Show SMILES COc1cc(Nc2ncc(Br)c(Nc3ccccc3)n2)cc(OC)c1OC
Show InChI InChI=1S/C19H19BrN4O3/c1-25-15-9-13(10-16(26-2)17(15)27-3)23-19-21-11-14(20)18(24-19)22-12-7-5-4-6-8-12/h4-11H,1-3H3,(H2,21,22,23,24)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379401
PNG
(5-bromo-4-(2-(trifluoromethyl)phenoxy)-N-(3,4,5-tr...)
Show SMILES COc1cc(Nc2ncc(Br)c(Oc3ccccc3C(F)(F)F)n2)cc(OC)c1OC
Show InChI InChI=1S/C20H17BrF3N3O4/c1-28-15-8-11(9-16(29-2)17(15)30-3)26-19-25-10-13(21)18(27-19)31-14-7-5-4-6-12(14)20(22,23)24/h4-10H,1-3H3,(H,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379405
PNG
((2-((5-bromo-2-((3,4,5-trimethoxyphenyl)amino)pyri...)
Show SMILES COc1cc(Nc2ncc(Br)c(Nc3ccccc3CO)n2)cc(OC)c1OC
Show InChI InChI=1S/C20H21BrN4O4/c1-27-16-8-13(9-17(28-2)18(16)29-3)23-20-22-10-14(21)19(25-20)24-15-7-5-4-6-12(15)11-26/h4-10,26H,11H2,1-3H3,(H2,22,23,24,25)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379406
PNG
(US10266549, Example 304a)
Show SMILES Nc1ccc(Nc2ncc(c(NC3CC3)n2)C(F)(F)F)cc1
Show InChI InChI=1S/C14H14F3N5/c15-14(16,17)11-7-19-13(22-12(11)20-9-5-6-9)21-10-3-1-8(18)2-4-10/h1-4,7,9H,5-6,18H2,(H2,19,20,21,22)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379415
PNG
(6-((4-((3-aminopropyl)amino)-5-(trifluoromethyl)py...)
Show SMILES NCCCNc1nc(Nc2ccc3NC(=O)CCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H19F3N6O/c18-17(19,20)12-9-23-16(26-15(12)22-7-1-6-21)24-11-3-4-13-10(8-11)2-5-14(27)25-13/h3-4,8-9H,1-2,5-7,21H2,(H,25,27)(H2,22,23,24,26)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379441
PNG
(US10266549, Example 335b)
Show SMILES COc1cc(Nc2nc(Oc3cccc4CCCN(C(C)=O)c34)ncc2Br)cc(O)c1OC
Show InChI InChI=1S/C23H23BrN4O5/c1-13(29)28-9-5-7-14-6-4-8-18(20(14)28)33-23-25-12-16(24)22(27-23)26-15-10-17(30)21(32-3)19(11-15)31-2/h4,6,8,10-12,30H,5,7,9H2,1-3H3,(H,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379124
PNG
(2-(2-(1H-indol-5-ylamino)-5-bromopyrimidin-4-ylami...)
Show SMILES CNC(=O)c1ccccc1Nc1nc(Nc2ccc3[nH]ccc3c2)ncc1Br
Show InChI InChI=1S/C20H17BrN6O/c1-22-19(28)14-4-2-3-5-17(14)26-18-15(21)11-24-20(27-18)25-13-6-7-16-12(10-13)8-9-23-16/h2-11,23H,1H3,(H,22,28)(H2,24,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379167
PNG
(N-Methyl-2-(5-phenyl-2-(3,4,5-trimethoxyphenylamin...)
Show SMILES CNC(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1-c1ccccc1
Show InChI InChI=1S/C27H27N5O4/c1-28-26(33)19-12-8-9-13-21(19)31-25-20(17-10-6-5-7-11-17)16-29-27(32-25)30-18-14-22(34-2)24(36-4)23(15-18)35-3/h5-16H,1-4H3,(H,28,33)(H2,29,30,31,32)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379180
PNG
(N-Methyl-2-(5-(trifluoromethyl)-2-(3,4,5-trimethox...)
Show SMILES CNC(=O)c1ccccc1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1C(F)(F)F
Show InChI InChI=1S/C22H21F3N4O5/c1-26-19(30)13-7-5-6-8-15(13)34-20-14(22(23,24)25)11-27-21(29-20)28-12-9-16(31-2)18(33-4)17(10-12)32-3/h5-11H,1-4H3,(H,26,30)(H,27,28,29)
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US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379223
PNG
(6-((4-((2,3-dihydro-1H-inden-5-yl)amino)-5-(triflu...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1Nc1ccc2CCCc2c1
Show InChI InChI=1S/C23H20F3N5O/c24-23(25,26)18-12-27-22(29-17-7-8-19-15(11-17)5-9-20(32)30-19)31-21(18)28-16-6-4-13-2-1-3-14(13)10-16/h4,6-8,10-12H,1-3,5,9H2,(H,30,32)(H2,27,28,29,31)
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US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379224
PNG
(US10266549, Example 130a)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1NC1Cc2ccccc2C1
Show InChI InChI=1S/C23H20F3N5O/c24-23(25,26)18-12-27-22(29-16-6-7-19-15(11-16)5-8-20(32)30-19)31-21(18)28-17-9-13-3-1-2-4-14(13)10-17/h1-4,6-7,11-12,17H,5,8-10H2,(H,30,32)(H2,27,28,29,31)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379234
PNG
(US10266549, Example 138*)
Show SMILES NC(=O)c1cccc(Nc2ncc(c(Nc3ccc4OCOc4c3)n2)C(F)(F)F)c1
Show InChI InChI=1S/C19H14F3N5O3/c20-19(21,22)13-8-24-18(26-11-3-1-2-10(6-11)16(23)28)27-17(13)25-12-4-5-14-15(7-12)30-9-29-14/h1-8H,9H2,(H2,23,28)(H2,24,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379238
PNG
(US10266549, Example 141b)
Show SMILES Fc1c(Nc2nc(Nc3ccc4OCOc4c3)ncc2C(F)(F)F)cccc1C(F)(F)F
Show InChI InChI=1S/C19H11F7N4O2/c20-15-10(18(21,22)23)2-1-3-12(15)29-16-11(19(24,25)26)7-27-17(30-16)28-9-4-5-13-14(6-9)32-8-31-13/h1-7H,8H2,(H2,27,28,29,30)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379239
PNG
(6-((5-bromo-4-((3-methoxyphenyl)amino)pyrimidin-2-...)
Show SMILES COc1cccc(Nc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2Br)c1
Show InChI InChI=1S/C20H18BrN5O2/c1-28-15-4-2-3-13(10-15)23-19-16(21)11-22-20(26-19)24-14-6-7-17-12(9-14)5-8-18(27)25-17/h2-4,6-7,9-11H,5,8H2,1H3,(H,25,27)(H2,22,23,24,26)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379251
PNG
(US10266549, Example 151b)
Show SMILES COCCNc1ncc(c(Nc2ccc3NC(=O)CCc3c2)n1)C(F)(F)F
Show InChI InChI=1S/C17H18F3N5O2/c1-27-7-6-21-16-22-9-12(17(18,19)20)15(25-16)23-11-3-4-13-10(8-11)2-5-14(26)24-13/h3-4,8-9H,2,5-7H2,1H3,(H,24,26)(H2,21,22,23,25)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379276
PNG
(US10266549, Example 168a)
Show SMILES FC(F)(F)c1cnc(NC2CCC2)nc1Nc1ccc2OCOc2c1
Show InChI InChI=1S/C16H15F3N4O2/c17-16(18,19)11-7-20-15(22-9-2-1-3-9)23-14(11)21-10-4-5-12-13(6-10)25-8-24-12/h4-7,9H,1-3,8H2,(H2,20,21,22,23)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379177
PNG
(2-(5-Bromo-2-(3,4,5-trimethoxyphenylamino)pyrimidi...)
Show SMILES CNC(=O)c1ccccc1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Br
Show InChI InChI=1S/C21H21BrN4O5/c1-23-19(27)13-7-5-6-8-15(13)31-20-14(22)11-24-21(26-20)25-12-9-16(28-2)18(30-4)17(10-12)29-3/h5-11H,1-4H3,(H,23,27)(H,24,25,26)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379285
PNG
(5-bromo-N4-cyclopropyl-N2-(1H-pyrrolo[2,3-b]pyridi...)
Show SMILES Brc1cnc(Nc2cnc3[nH]ccc3c2)nc1NC1CC1
Show InChI InChI=1S/C14H13BrN6/c15-11-7-18-14(21-13(11)19-9-1-2-9)20-10-5-8-3-4-16-12(8)17-6-10/h3-7,9H,1-2H2,(H,16,17)(H2,18,19,20,21)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379304
PNG
(5-bromo-N4-cyclopropyl-N2-(3,4,5-trimethoxyphenyl)...)
Show SMILES COc1cc(Nc2ncc(c(NC3CC3)n2)C(F)(F)F)cc(OC)c1OC
Show InChI InChI=1S/C17H19F3N4O3/c1-25-12-6-10(7-13(26-2)14(12)27-3)23-16-21-8-11(17(18,19)20)15(24-16)22-9-4-5-9/h6-9H,4-5H2,1-3H3,(H2,21,22,23,24)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379319
PNG
(6-((4-(cyclopropyl(methyl)amino)-5-(trifluoromethy...)
Show SMILES CN(C1CC1)c1nc(Nc2ccc3NC(=O)CCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C18H18F3N5O/c1-26(12-4-5-12)16-13(18(19,20)21)9-22-17(25-16)23-11-3-6-14-10(8-11)2-7-15(27)24-14/h3,6,8-9,12H,2,4-5,7H2,1H3,(H,24,27)(H,22,23,25)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379343
PNG
(US10266549, Example 221a)
Show SMILES FC(F)(F)c1cnc(Nc2ccnnc2)nc1NC1CC1
Show InChI InChI=1S/C12H11F3N6/c13-12(14,15)9-6-16-11(20-8-3-4-17-18-5-8)21-10(9)19-7-1-2-7/h3-7H,1-2H2,(H2,16,17,19,20,21)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379351
PNG
(N4-cyclopropyl-N2-(6-methoxypyridin-2-yl)-5-(trifl...)
Show SMILES COc1cccc(Nc2ncc(c(NC3CC3)n2)C(F)(F)F)n1
Show InChI InChI=1S/C14H14F3N5O/c1-23-11-4-2-3-10(20-11)21-13-18-7-9(14(15,16)17)12(22-13)19-8-5-6-8/h2-4,7-8H,5-6H2,1H3,(H2,18,19,20,21,22)
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US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379356
PNG
(5,5′-((5-bromopyrimidine-2,4-diyl)bis(azaned...)
Show SMILES Brc1cnc(Nc2ccc3[nH]c(=O)[nH]c3c2)nc1Nc1ccc2[nH]c(=O)[nH]c2c1
Show InChI InChI=1S/C18H13BrN8O2/c19-10-7-20-16(22-9-2-4-12-14(6-9)26-18(29)24-12)27-15(10)21-8-1-3-11-13(5-8)25-17(28)23-11/h1-7H,(H2,23,25,28)(H2,24,26,29)(H2,20,21,22,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379371
PNG
(2-((5-bromo-2-((3,4,5-trimethoxyphenyl)amino)pyrim...)
Show SMILES CNC(=O)c1cccc(OC)c1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Br
Show InChI InChI=1S/C22H23BrN4O6/c1-24-20(28)13-7-6-8-15(29-2)18(13)33-21-14(23)11-25-22(27-21)26-12-9-16(30-3)19(32-5)17(10-12)31-4/h6-11H,1-5H3,(H,24,28)(H,25,26,27)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379375
PNG
(2-((5-bromo-2-((3,4,5-trimethoxyphenyl)amino)pyrim...)
Show SMILES CNC(=O)c1c(O)cccc1Oc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Br
Show InChI InChI=1S/C21H21BrN4O6/c1-23-19(28)17-13(27)6-5-7-14(17)32-20-12(22)10-24-21(26-20)25-11-8-15(29-2)18(31-4)16(9-11)30-3/h5-10,27H,1-4H3,(H,23,28)(H,24,25,26)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379388
PNG
((2-((5-bromo-2-((3,4,5-trimethoxyphenyl)amino)pyri...)
Show SMILES COc1cc(Nc2ncc(Br)c(Oc3ccccc3C(=O)N3CCCC3)n2)cc(OC)c1OC
Show InChI InChI=1S/C24H25BrN4O5/c1-31-19-12-15(13-20(32-2)21(19)33-3)27-24-26-14-17(25)22(28-24)34-18-9-5-4-8-16(18)23(30)29-10-6-7-11-29/h4-5,8-9,12-14H,6-7,10-11H2,1-3H3,(H,26,27,28)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379400
PNG
(N2-(1H-benzo[d]imidazol-6-yl)-N4-(5-cyclobutyl-1H-...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3nc[nH]c3c2)nc1Nc1cc([nH]n1)C1CCC1
Show InChI InChI=1S/C19H17F3N8/c20-19(21,22)12-8-23-18(26-11-4-5-13-15(6-11)25-9-24-13)28-17(12)27-16-7-14(29-30-16)10-2-1-3-10/h4-10H,1-3H2,(H,24,25)(H3,23,26,27,28,29,30)
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Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379408
PNG
(N4-cyclopropyl-N2-(quinoxalin-6-yl)-5-(trifluorome...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3nccnc3c2)nc1NC1CC1
Show InChI InChI=1S/C16H13F3N6/c17-16(18,19)11-8-22-15(25-14(11)23-9-1-2-9)24-10-3-4-12-13(7-10)21-6-5-20-12/h3-9H,1-2H2,(H2,22,23,24,25)
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n/an/a<200n/an/an/an/an/an/a



Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379115
PNG
(2-(5-Bromo-2-(3,4,5-trimethoxyphenylamino)pyrimidi...)
Show SMILES CNC(=O)c1ccccc1Nc1nc(Nc2cc(OC)c(OC)c(OC)c2)ncc1Br
Show InChI InChI=1S/C21H22BrN5O4/c1-23-20(28)13-7-5-6-8-15(13)26-19-14(22)11-24-21(27-19)25-12-9-16(29-2)18(31-4)17(10-12)30-3/h5-11H,1-4H3,(H,23,28)(H2,24,25,26,27)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379143
PNG
(6-(4-(Benzylamino)-5-(trifluoromethyl)pyrimidin-2-...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1NCc1ccccc1
Show InChI InChI=1S/C21H18F3N5O/c22-21(23,24)16-12-26-20(29-19(16)25-11-13-4-2-1-3-5-13)27-15-7-8-17-14(10-15)6-9-18(30)28-17/h1-5,7-8,10,12H,6,9,11H2,(H,28,30)(H2,25,26,27,29)
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n/an/a<200n/an/an/an/an/an/a



Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379158
PNG
(N-Methyl-2-(2-(3,4,5-trimethoxyphenylamino)pyrimid...)
Show SMILES CNC(=O)c1ccccc1Nc1ccnc(Nc2cc(OC)c(OC)c(OC)c2)n1
Show InChI InChI=1S/C21H23N5O4/c1-22-20(27)14-7-5-6-8-15(14)25-18-9-10-23-21(26-18)24-13-11-16(28-2)19(30-4)17(12-13)29-3/h5-12H,1-4H3,(H,22,27)(H2,23,24,25,26)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379222
PNG
(N-methyl-3-((2-((2-oxo-1,2,3,4-tetrahydroquinolin-...)
Show SMILES CNC(=O)c1cccc(Nc2nc(Nc3ccc4NC(=O)CCc4c3)ncc2C(F)(F)F)c1
Show InChI InChI=1S/C22H19F3N6O2/c1-26-20(33)13-3-2-4-14(10-13)28-19-16(22(23,24)25)11-27-21(31-19)29-15-6-7-17-12(9-15)5-8-18(32)30-17/h2-4,6-7,9-11H,5,8H2,1H3,(H,26,33)(H,30,32)(H2,27,28,29,31)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379230
PNG
(6,6′-((5-chloropyrimidine-2,4-diyl)bis(azane...)
Show SMILES Clc1cnc(Nc2ccc3NC(=O)CCc3c2)nc1Nc1ccc2NC(=O)CCc2c1
Show InChI InChI=1S/C22H19ClN6O2/c23-16-11-24-22(26-15-4-6-18-13(10-15)2-8-20(31)28-18)29-21(16)25-14-3-5-17-12(9-14)1-7-19(30)27-17/h3-6,9-11H,1-2,7-8H2,(H,27,30)(H,28,31)(H2,24,25,26,29)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379250
PNG
(US10266549, Example 151a)
Show SMILES COCCNc1nc(Nc2ccc3NC(=O)CCc3c2)ncc1C(F)(F)F
Show InChI InChI=1S/C17H18F3N5O2/c1-27-7-6-21-15-12(17(18,19)20)9-22-16(25-15)23-11-3-4-13-10(8-11)2-5-14(26)24-13/h3-4,8-9H,2,5-7H2,1H3,(H,24,26)(H2,21,22,23,25)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379274
PNG
(US10266549, Example 167a)
Show SMILES FC(F)(F)c1cnc(NCC2CC2)nc1Nc1ccc2OCOc2c1
Show InChI InChI=1S/C16H15F3N4O2/c17-16(18,19)11-7-21-15(20-6-9-1-2-9)23-14(11)22-10-3-4-12-13(5-10)25-8-24-12/h3-5,7,9H,1-2,6,8H2,(H2,20,21,22,23)
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n/an/a<200n/an/an/an/an/an/a



Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379286
PNG
(6-((4-cyclobutoxy-5-(trifluoromethyl)pyrimidin-2-y...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1OC1CCC1
Show InChI InChI=1S/C18H17F3N4O2/c19-18(20,21)13-9-22-17(25-16(13)27-12-2-1-3-12)23-11-5-6-14-10(8-11)4-7-15(26)24-14/h5-6,8-9,12H,1-4,7H2,(H,24,26)(H,22,23,25)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase ULK1


(Homo sapiens (Human))
BDBM379336
PNG
(6-((4-((cyclopropylmethyl)amino)-5-(trifluoromethy...)
Show SMILES FC(F)(F)c1cnc(Nc2ccc3NC(=O)CCc3c2)nc1NCC1CC1
Show InChI InChI=1S/C18H18F3N5O/c19-18(20,21)13-9-23-17(26-16(13)22-8-10-1-2-10)24-12-4-5-14-11(7-12)3-6-15(27)25-14/h4-5,7,9-10H,1-3,6,8H2,(H,25,27)(H2,22,23,24,26)
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Salk Institute

US Patent


Assay Description
Gamma-32P assays to measure ULK1 kinase activity were performed as previously described. Briefly, Flag ULK1 was transfected into HEK293T cells and 20...


US Patent US10266549 (2019)


BindingDB Entry DOI: 10.7270/Q2N30084
More data for this
Ligand-Target Pair
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* indicates data uncertainty>20%