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Patent code US10206907

Compile Data Set for Download or QSAR

Found 633 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
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349079
PNG
(Cyclopropanecarboxylic acid {5-[4-(6-chloro-pyridi...)
Show SMILES Clc1ccc(COc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)cn1
Show InChI InChI=1S/C22H18ClN5O2/c23-19-11-4-14(12-24-19)13-30-17-9-7-15(8-10-17)18-2-1-3-20-25-22(27-28(18)20)26-21(29)16-5-6-16/h1-4,7-12,16H,5-6,13H2,(H,26,27,29)
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n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349125
PNG
(Cyclopropanecarboxylic acid (5-[4-(pyridin-2- ylam...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNc4ccccn4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C22H20N6O/c29-21(17-11-12-17)26-22-25-20-6-3-4-18(28(20)27-22)16-9-7-15(8-10-16)14-24-19-5-1-2-13-23-19/h1-10,13,17H,11-12,14H2,(H,23,24)(H,26,27,29)
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n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349162
PNG
(Cyclopropanecarboxylic acid (5-{4-[acetyl-(6-cyano...)
Show SMILES CC(=O)N(Cc1ccc(nc1)C#N)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C25H21N7O2/c1-16(33)31(15-17-5-10-20(13-26)27-14-17)21-11-8-18(9-12-21)22-3-2-4-23-28-25(30-32(22)23)29-24(34)19-6-7-19/h2-5,8-12,14,19H,6-7,15H2,1H3,(H,29,30,34)
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n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK3 (aa 781-1124)


(Homo sapiens (Human))
BDBM348922
PNG
(N-(5-(4-(pyridin-3- ylmethoxy)phenyl)- [1,2,4]tria...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(OCc4cccnc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C22H19N5O2/c28-21(17-6-7-17)25-22-24-20-5-1-4-19(27(20)26-22)16-8-10-18(11-9-16)29-14-15-3-2-12-23-13-15/h1-5,8-13,17H,6-7,14H2,(H,25,26,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK3 catalytic domain (amino acids 781-1124; catalog number PV3855) was purchased from Invitrogen. 0.025 mU of JAK3 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK3 (aa 781-1124)


(Homo sapiens (Human))
BDBM348979
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2,4]triazolo[1...)
Show SMILES FC(F)(F)c1ccc(CCNC(=O)c2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)cc1
Show InChI InChI=1S/C26H22F3N5O2/c27-26(28,29)20-12-4-16(5-13-20)14-15-30-23(35)18-8-6-17(7-9-18)21-2-1-3-22-31-25(33-34(21)22)32-24(36)19-10-11-19/h1-9,12-13,19H,10-11,14-15H2,(H,30,35)(H,32,33,36)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK3 catalytic domain (amino acids 781-1124; catalog number PV3855) was purchased from Invitrogen. 0.025 mU of JAK3 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
TYK2 (aa871-1187)


(Homo sapiens (Human))
BDBM349167
PNG
(Cyclopropanecarboxylic acid {5-[4-(isoxazol-3- yla...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNc4ccon4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C20H18N6O2/c27-19(15-8-9-15)23-20-22-18-3-1-2-16(26(18)24-20)14-6-4-13(5-7-14)12-21-17-10-11-28-25-17/h1-7,10-11,15H,8-9,12H2,(H,21,25)(H,23,24,27)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human TYK2 catalytic domain (amino acids 871-1187; catalog number 08-147) was purchased from Carna biosciences. 5 ng of TYK2 was incubate...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348911
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2,4]triazolo[1...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)C(=O)Nc3ccncc3)n2n1)C1CC1
Show InChI InChI=1S/C22H18N6O2/c29-20(24-17-10-12-23-13-11-17)15-6-4-14(5-7-15)18-2-1-3-19-25-22(27-28(18)19)26-21(30)16-8-9-16/h1-7,10-13,16H,8-9H2,(H,23,24,29)(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348915
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2,4]triazolo[1...)
Show SMILES Fc1cccc(CNC(=O)c2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)c1
Show InChI InChI=1S/C24H20FN5O2/c25-19-4-1-3-15(13-19)14-26-22(31)17-9-7-16(8-10-17)20-5-2-6-21-27-24(29-30(20)21)28-23(32)18-11-12-18/h1-10,13,18H,11-12,14H2,(H,26,31)(H,28,29,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348940
PNG
(N-(5-(4-(2- fluorophenylsulfonamido) phenyl)-[1,2,...)
Show SMILES Fc1ccccc1S(=O)(=O)Nc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C22H18FN5O3S/c23-17-4-1-2-6-19(17)32(30,31)27-16-12-10-14(11-13-16)18-5-3-7-20-24-22(26-28(18)20)25-21(29)15-8-9-15/h1-7,10-13,15,27H,8-9H2,(H,25,26,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348982
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2,4]triazolo[1...)
Show SMILES Fc1cc(ccc1-c1cccc2nc(NC(=O)C3CC3)nn12)C(=O)NCCOc1ccccc1
Show InChI InChI=1S/C25H22FN5O3/c26-20-15-17(23(32)27-13-14-34-18-5-2-1-3-6-18)11-12-19(20)21-7-4-8-22-28-25(30-31(21)22)29-24(33)16-9-10-16/h1-8,11-12,15-16H,9-10,13-14H2,(H,27,32)(H,29,30,33)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348997
PNG
(N-(5-(4-(2-(4- fluorophenoxy)ethoxy)phenyl)- [1,2,...)
Show SMILES Fc1ccc(OCCOc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)cc1
Show InChI InChI=1S/C24H21FN4O3/c25-18-8-12-20(13-9-18)32-15-14-31-19-10-6-16(7-11-19)21-2-1-3-22-26-24(28-29(21)22)27-23(30)17-4-5-17/h1-3,6-13,17H,4-5,14-15H2,(H,27,28,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349039
PNG
(N-(5-(4- (benzyl(methyl)amino)phenyl)- [1,2,4]tria...)
Show SMILES CN(Cc1ccccc1)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C24H23N5O/c1-28(16-17-6-3-2-4-7-17)20-14-12-18(13-15-20)21-8-5-9-22-25-24(27-29(21)22)26-23(30)19-10-11-19/h2-9,12-15,19H,10-11,16H2,1H3,(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349057
PNG
(N-(5-(4-(3,3- dimethylpiperidine-1- carbonyl)pheny...)
Show SMILES CC1(C)CCCN(C1)C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C24H27N5O2/c1-24(2)13-4-14-28(15-24)22(31)18-11-7-16(8-12-18)19-5-3-6-20-25-23(27-29(19)20)26-21(30)17-9-10-17/h3,5-8,11-12,17H,4,9-10,13-15H2,1-2H3,(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349059
PNG
(1-cyano-N-(4-(2- (cyclopropanecarboxamido)- [1,2,4...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(NC(=O)C4(CC4)C#N)cc3)n2n1)C1CC1
Show InChI InChI=1S/C21H18N6O2/c22-12-21(10-11-21)19(29)23-15-8-6-13(7-9-15)16-2-1-3-17-24-20(26-27(16)17)25-18(28)14-4-5-14/h1-3,6-9,14H,4-5,10-11H2,(H,23,29)(H,25,26,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349071
PNG
(US10206907, Compound 190 | methyl 6-((4-(2- (cyclo...)
Show SMILES COC(=O)c1ccc(COc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)nc1
Show InChI InChI=1S/C24H21N5O4/c1-32-23(31)17-7-10-18(25-13-17)14-33-19-11-8-15(9-12-19)20-3-2-4-21-26-24(28-29(20)21)27-22(30)16-5-6-16/h2-4,7-13,16H,5-6,14H2,1H3,(H,27,28,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349080
PNG
(Cyclopropanecarboxylic acid {5-[4-(1-methyl-1H- [1...)
Show SMILES Cn1cnc(COc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)n1
Show InChI InChI=1S/C20H19N7O2/c1-26-12-21-17(24-26)11-29-15-9-7-13(8-10-15)16-3-2-4-18-22-20(25-27(16)18)23-19(28)14-5-6-14/h2-4,7-10,12,14H,5-6,11H2,1H3,(H,23,25,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349104
PNG
(Cyclopropanecarboxylic acid {5-[4-(pyridin-3- ylam...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNc4cccnc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C22H20N6O/c29-21(17-10-11-17)26-22-25-20-5-1-4-19(28(20)27-22)16-8-6-15(7-9-16)13-24-18-3-2-12-23-14-18/h1-9,12,14,17,24H,10-11,13H2,(H,26,27,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349112
PNG
(Cyclopropanecarboxylic acid {5-[4-(2-phenyl-morpho...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CN4CCOC(C4)c4ccccc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C27H27N5O2/c33-26(22-13-14-22)29-27-28-25-8-4-7-23(32(25)30-27)20-11-9-19(10-12-20)17-31-15-16-34-24(18-31)21-5-2-1-3-6-21/h1-12,22,24H,13-18H2,(H,29,30,33)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349114
PNG
(Cyclopropanecarboxylic acid {5-[4-(4-fluoro-piperi...)
Show SMILES FC1CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)CC1
Show InChI InChI=1S/C22H24FN5O/c23-18-10-12-27(13-11-18)14-15-4-6-16(7-5-15)19-2-1-3-20-24-22(26-28(19)20)25-21(29)17-8-9-17/h1-7,17-18H,8-14H2,(H,25,26,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349116
PNG
(Cyclopropanecarboxylic acid [5-(4-{[6-(4-methyl-pi...)
Show SMILES CN1CCN(CC1)c1ccc(NCc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)cn1
Show InChI InChI=1S/C27H30N8O/c1-33-13-15-34(16-14-33)24-12-11-22(18-29-24)28-17-19-5-7-20(8-6-19)23-3-2-4-25-30-27(32-35(23)25)31-26(36)21-9-10-21/h2-8,11-12,18,21,28H,9-10,13-17H2,1H3,(H,31,32,36)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349127
PNG
(Cyclopropanecarboxylic acid (5-{4-[(2,6-difluoro- ...)
Show SMILES Fc1cccc(F)c1NCc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C23H19F2N5O/c24-17-3-1-4-18(25)21(17)26-13-14-7-9-15(10-8-14)19-5-2-6-20-27-23(29-30(19)20)28-22(31)16-11-12-16/h1-10,16,26H,11-13H2,(H,28,29,31)
PDB

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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349134
PNG
(Cyclobutanecarboxylic acid 4- [2-(cyclopropanecarb...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNC(=O)C4CCC4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C22H23N5O2/c28-20(16-3-1-4-16)23-13-14-7-9-15(10-8-14)18-5-2-6-19-24-22(26-27(18)19)25-21(29)17-11-12-17/h2,5-10,16-17H,1,3-4,11-13H2,(H,23,28)(H,25,26,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349138
PNG
(Cyclopropanecarboxylic acid 4-[2-(cyclopropanecarb...)
Show SMILES O=C(NCc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12)C1CC1
Show InChI InChI=1S/C21H21N5O2/c27-19(15-8-9-15)22-12-13-4-6-14(7-5-13)17-2-1-3-18-23-21(25-26(17)18)24-20(28)16-10-11-16/h1-7,15-16H,8-12H2,(H,22,27)(H,24,25,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349154
PNG
(Cyclopropanecarboxylic acid {5-[4-(3-cyano-azetidi...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)N3CC(C3)C#N)n2n1)C1CC1
Show InChI InChI=1S/C20H18N6O/c21-10-13-11-25(12-13)16-8-6-14(7-9-16)17-2-1-3-18-22-20(24-26(17)18)23-19(27)15-4-5-15/h1-3,6-9,13,15H,4-5,11-12H2,(H,23,24,27)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM50031740
PNG
(CHEMBL3360357 | US10206907, Compound 304)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNC4CCS(=O)(=O)C4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C21H23N5O3S/c27-20(16-8-9-16)24-21-23-19-3-1-2-18(26(19)25-21)15-6-4-14(5-7-15)12-22-17-10-11-30(28,29)13-17/h1-7,16-17,22H,8-13H2,(H,24,25,27)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349182
PNG
(Cyclopropanecarboxylic acid (5-{4-[2-(3,3-difluoro...)
Show SMILES FC1(F)CN(C1)C(=O)Cc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C21H19F2N5O2/c22-21(23)11-27(12-21)18(29)10-13-4-6-14(7-5-13)16-2-1-3-17-24-20(26-28(16)17)25-19(30)15-8-9-15/h1-7,15H,8-12H2,(H,25,26,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348900
PNG
(N-(5-(4-(N- cyclopropylsulfamoyl)phenyl)- [1,2,4]t...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)S(=O)(=O)NC3CC3)n2n1)C1CC1
Show InChI InChI=1S/C19H19N5O3S/c25-18(13-4-5-13)21-19-20-17-3-1-2-16(24(17)22-19)12-6-10-15(11-7-12)28(26,27)23-14-8-9-14/h1-3,6-7,10-11,13-14,23H,4-5,8-9H2,(H,21,22,25)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348916
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2.4]triazolo[1...)
Show SMILES CN(C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12)c1ccccc1
Show InChI InChI=1S/C24H21N5O2/c1-28(19-6-3-2-4-7-19)23(31)18-14-10-16(11-15-18)20-8-5-9-21-25-24(27-29(20)21)26-22(30)17-12-13-17/h2-11,14-15,17H,12-13H2,1H3,(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348923
PNG
(N-(5-(4-(pyridin-2- ylmethoxy)phenyl)- [1,2,4]tria...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(OCc4ccccn4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C22H19N5O2/c28-21(16-7-8-16)25-22-24-20-6-3-5-19(27(20)26-22)15-9-11-18(12-10-15)29-14-17-4-1-2-13-23-17/h1-6,9-13,16H,7-8,14H2,(H,25,26,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348962
PNG
(N-(5-(4-(2- phenylethylsulfonamido) phenyl)-[1,2,4...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(NS(=O)(=O)CCc4ccccc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C24H23N5O3S/c30-23(19-9-10-19)26-24-25-22-8-4-7-21(29(22)27-24)18-11-13-20(14-12-18)28-33(31,32)16-15-17-5-2-1-3-6-17/h1-8,11-14,19,28H,9-10,15-16H2,(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348970
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2,4]triazolo[1...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)C(=O)NCCc3ccccc3)n2n1)C1CC1
Show InChI InChI=1S/C25H23N5O2/c31-23(26-16-15-17-5-2-1-3-6-17)19-11-9-18(10-12-19)21-7-4-8-22-27-25(29-30(21)22)28-24(32)20-13-14-20/h1-12,20H,13-16H2,(H,26,31)(H,28,29,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM348989
PNG
(N-(5-(1-benzyl-1H-pyrazol-4- yl)-[1,2,4]triazolo[1...)
Show SMILES O=C(Nc1nc2cccc(-c3cnn(Cc4ccccc4)c3)n2n1)C1CC1
Show InChI InChI=1S/C20H18N6O/c27-19(15-9-10-15)23-20-22-18-8-4-7-17(26(18)24-20)16-11-21-25(13-16)12-14-5-2-1-3-6-14/h1-8,11,13,15H,9-10,12H2,(H,23,24,27)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349089
PNG
(Cyclopropanecarboxylic acid {5-[4-(acetyl-pyridin-...)
Show SMILES CC(=O)N(Cc1ccccn1)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C24H22N6O2/c1-16(31)29(15-19-5-2-3-14-25-19)20-12-10-17(11-13-20)21-6-4-7-22-26-24(28-30(21)22)27-23(32)18-8-9-18/h2-7,10-14,18H,8-9,15H2,1H3,(H,27,28,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349105
PNG
(Cyclopropanecarboxylic acid (5-{4-[(4-cyanomethyl-...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(CNc4ccc(CC#N)cc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C25H22N6O/c26-15-14-17-6-12-21(13-7-17)27-16-18-4-8-19(9-5-18)22-2-1-3-23-28-25(30-31(22)23)29-24(32)20-10-11-20/h1-9,12-13,20,27H,10-11,14,16H2,(H,29,30,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349119
PNG
(Cyclopropanecarboxylic acid [5-(4-phenoxymethyl-ph...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(COc4ccccc4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C23H20N4O2/c28-22(18-13-14-18)25-23-24-21-8-4-7-20(27(21)26-23)17-11-9-16(10-12-17)15-29-19-5-2-1-3-6-19/h1-12,18H,13-15H2,(H,25,26,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349121
PNG
(Cyclopropanecarboxylic acid {5-[4-(4-trifluorometh...)
Show SMILES FC(F)(F)C1CCN(Cc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)CC1
Show InChI InChI=1S/C23H24F3N5O/c24-23(25,26)18-10-12-30(13-11-18)14-15-4-6-16(7-5-15)19-2-1-3-20-27-22(29-31(19)20)28-21(32)17-8-9-17/h1-7,17-18H,8-14H2,(H,28,29,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK2 (aa 808-1132)


(Homo sapiens (Human))
BDBM349196
PNG
(4-[2-(Cyclopropanecarbonyl- amino)-[1,2,4]triazolo...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)C(=O)Nc3nc[nH]n3)n2n1)C1CC1
Show InChI InChI=1S/C19H16N8O2/c28-16(23-18-20-10-21-25-18)12-6-4-11(5-7-12)14-2-1-3-15-22-19(26-27(14)15)24-17(29)13-8-9-13/h1-7,10,13H,8-9H2,(H,24,26,29)(H2,20,21,23,25,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK2 catalytic domain (amino acids 808-1132; catalog number PV4210) was purchased from Invitrogen. 0.025 mU of JAK2 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK3 (aa 781-1124)


(Homo sapiens (Human))
BDBM349038
PNG
(N-(5-(4-(4-benzyl-4- hydroxypiperidine-1- carbonyl...)
Show SMILES OC1(Cc2ccccc2)CCN(CC1)C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C29H29N5O3/c35-26(22-11-12-22)31-28-30-25-8-4-7-24(34(25)32-28)21-9-13-23(14-10-21)27(36)33-17-15-29(37,16-18-33)19-20-5-2-1-3-6-20/h1-10,13-14,22,37H,11-12,15-19H2,(H,31,32,35)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK3 catalytic domain (amino acids 781-1124; catalog number PV3855) was purchased from Invitrogen. 0.025 mU of JAK3 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK3 (aa 781-1124)


(Homo sapiens (Human))
BDBM128101
PNG
(US10206907, Compound 330 | US8796457, 1 | US950575...)
Show SMILES CC1(C)CN(C1)C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C22H23N5O2/c1-22(2)12-26(13-22)20(29)16-10-6-14(7-11-16)17-4-3-5-18-23-21(25-27(17)18)24-19(28)15-8-9-15/h3-7,10-11,15H,8-9,12-13H2,1-2H3,(H,24,25,28)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK3 catalytic domain (amino acids 781-1124; catalog number PV3855) was purchased from Invitrogen. 0.025 mU of JAK3 was incubated w...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348897
PNG
(N-(5-(4-benzoylphenyl)- [1,2,4]triazolo[1,5-a]pyri...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(cc3)C(=O)c3ccccc3)n2n1)C1CC1
Show InChI InChI=1S/C23H18N4O2/c28-21(16-5-2-1-3-6-16)17-11-9-15(10-12-17)19-7-4-8-20-24-23(26-27(19)20)25-22(29)18-13-14-18/h1-12,18H,13-14H2,(H,25,26,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348916
PNG
(4-(2- (cyclopropanecarboxamido)- [1,2.4]triazolo[1...)
Show SMILES CN(C(=O)c1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12)c1ccccc1
Show InChI InChI=1S/C24H21N5O2/c1-28(19-6-3-2-4-7-19)23(31)18-14-10-16(11-15-18)20-8-5-9-21-25-24(27-29(20)21)26-22(30)17-12-13-17/h2-11,14-15,17H,12-13H2,1H3,(H,26,27,30)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348919
PNG
(N-(5-(4-(4- fluorophenylsulfonamido) phenyl)-[1,2,...)
Show SMILES Fc1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1cccc2nc(NC(=O)C3CC3)nn12
Show InChI InChI=1S/C22H18FN5O3S/c23-16-8-12-18(13-9-16)32(30,31)27-17-10-6-14(7-11-17)19-2-1-3-20-24-22(26-28(19)20)25-21(29)15-4-5-15/h1-3,6-13,15,27H,4-5H2,(H,25,26,29)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348964
PNG
(N-(5-(4-((6- (trifluoromethyl)pyridin-3- yl)methox...)
Show SMILES FC(F)(F)c1ccc(COc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)cn1
Show InChI InChI=1S/C23H18F3N5O2/c24-23(25,26)19-11-4-14(12-27-19)13-33-17-9-7-15(8-10-17)18-2-1-3-20-28-22(30-31(18)20)29-21(32)16-5-6-16/h1-4,7-12,16H,5-6,13H2,(H,29,30,32)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348971
PNG
(N-(5-(4-(2-(3- fluorophenyl)ethylsulfonamido) phen...)
Show SMILES Fc1cccc(CCS(=O)(=O)Nc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)c1
Show InChI InChI=1S/C24H22FN5O3S/c25-19-4-1-3-16(15-19)13-14-34(32,33)29-20-11-9-17(10-12-20)21-5-2-6-22-26-24(28-30(21)22)27-23(31)18-7-8-18/h1-6,9-12,15,18,29H,7-8,13-14H2,(H,27,28,31)
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GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348972
PNG
(N-(5-(2-fluoro-4-(piperidine- 1-carbonyl)phenyl)- ...)
Show SMILES Fc1cc(ccc1-c1cccc2nc(NC(=O)C3CC3)nn12)C(=O)N1CCCCC1
Show InChI InChI=1S/C22H22FN5O2/c23-17-13-15(21(30)27-11-2-1-3-12-27)9-10-16(17)18-5-4-6-19-24-22(26-28(18)19)25-20(29)14-7-8-14/h4-6,9-10,13-14H,1-3,7-8,11-12H2,(H,25,26,29)
PDB

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UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348981
PNG
(N-(5-(4-((1,2,4-oxadiazol-3- yl)methoxy)phenyl)- [...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(OCc4ncon4)cc3)n2n1)C1CC1
Show InChI InChI=1S/C19H16N6O3/c26-18(13-4-5-13)22-19-21-17-3-1-2-15(25(17)23-19)12-6-8-14(9-7-12)27-10-16-20-11-28-24-16/h1-3,6-9,11,13H,4-5,10H2,(H,22,23,26)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM348998
PNG
(N-(5-(4-(2-(3- fluorophenylamino)-2- oxoethoxy)phe...)
Show SMILES Fc1cccc(NC(=O)COc2ccc(cc2)-c2cccc3nc(NC(=O)C4CC4)nn23)c1
Show InChI InChI=1S/C24H20FN5O3/c25-17-3-1-4-18(13-17)26-22(31)14-33-19-11-9-15(10-12-19)20-5-2-6-21-27-24(29-30(20)21)28-23(32)16-7-8-16/h1-6,9-13,16H,7-8,14H2,(H,26,31)(H,28,29,32)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349003
PNG
(Cyclopropanecarboxylic Acid [5-(1-benzyl-1H-indol-...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc4n(Cc5ccccc5)ccc4c3)n2n1)C1CC1
Show InChI InChI=1S/C25H21N5O/c31-24(18-9-10-18)27-25-26-23-8-4-7-22(30(23)28-25)19-11-12-21-20(15-19)13-14-29(21)16-17-5-2-1-3-6-17/h1-8,11-15,18H,9-10,16H2,(H,27,28,31)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349004
PNG
(N-(5-(4-(2- phenoxyethylsulfonamido) phenyl)-[1,2,...)
Show SMILES O=C(Nc1nc2cccc(C3=CC=C(CC3)NS(=O)(=O)CCOc3ccccc3)n2n1)C1CC1
Show InChI InChI=1S/C24H25N5O4S/c30-23(18-9-10-18)26-24-25-22-8-4-7-21(29(22)27-24)17-11-13-19(14-12-17)28-34(31,32)16-15-33-20-5-2-1-3-6-20/h1-8,11,13,18,28H,9-10,12,14-16H2,(H,26,27,30)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

More data for this
Ligand-Target Pair
JAK1 (aa850-1154)


(Homo sapiens (Human))
BDBM349005
PNG
(N-(5-(6- (phenethylamino)pyridin-3- yl)-[1,2,4]tri...)
Show SMILES O=C(Nc1nc2cccc(-c3ccc(NCCc4ccccc4)nc3)n2n1)C1CC1
Show InChI InChI=1S/C23H22N6O/c30-22(17-9-10-17)27-23-26-21-8-4-7-19(29(21)28-23)18-11-12-20(25-15-18)24-14-13-16-5-2-1-3-6-16/h1-8,11-12,15,17H,9-10,13-14H2,(H,24,25)(H,27,28,30)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



GALAPAGOS NV

US Patent


Assay Description
Recombinant human JAK1 catalytic domain (amino acids 850-1154; catalog number 08-144) was purchased from Carna Biosciences. 10 ng of JAK1 was incubat...


US Patent US10206907 (2019)

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