Compile Data Set for Download or QSAR
Found 1567 Enz. Inhib. hit(s) with Target = 'Tyrosine-protein kinase JAK1 [837-1142]'
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197716(US9216984, 1)
Show SMILES CCCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 0.340nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197717(US9216984, 2)
Show SMILES CCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 0.570nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197716(US9216984, 1)
Show SMILES CCCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 0.630nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197717(US9216984, 2)
Show SMILES CCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 1.80nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197717(US9216984, 2)
Show SMILES CCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 2nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM197716(US9216984, 1)
Show SMILES CCCCCC(CC#N)n1cc(cn1)-c1ncnc2[nH]ccc12
Affinity DataIC50: 3.90nMpH: 7.8 T: 2°CAssay Description:The compounds of the invention were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al.,...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400620(US10695337, Example 376 | US11285140, Example 376 ...)
Show SMILES FC(F)(F)c1nc(CN2CCCC2)cc(n1)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C30H32F3N11O/c31-30(32,33)28-39-21(16-41-9-1-2-10-41)13-24(40-28)27(45)42-11-4-22(5-12-42)43-17-29(18-43,6-7-34)44-15-20(14-38-44)25-23-3-8-35-26(23)37-19-36-25/h3,8,13-15,19,22H,1-2,4-6,9-12,16-18H2,(H,35,36,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400621(US10695337, Example 377 | US11285140, Example 377 ...)
Show SMILES F[C@H]1CCN(Cc2cc(nc(n2)C(F)(F)F)C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)C1
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400622(US10695337, Example 378 | US11285140, Example 378 ...)
Show SMILES F[C@@H]1CCN(Cc2cc(nc(n2)C(F)(F)F)C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)C1
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400623(US10695337, Example 379 | US11285140, Example 379 ...)
Show SMILES FC(F)(F)c1nc(CN2CCC(F)(F)C2)cc(n1)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C30H30F5N11O/c31-29(32)5-10-43(17-29)14-20-11-23(42-27(41-20)30(33,34)35)26(47)44-8-2-21(3-9-44)45-15-28(16-45,4-6-36)46-13-19(12-40-46)24-22-1-7-37-25(22)39-18-38-24/h1,7,11-13,18,21H,2-5,8-10,14-17H2,(H,37,38,39)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400624(US10695337, Example 380 | US11285140, Example 380 ...)
Show SMILES CC(C)(C)NCc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C30H34F3N11O/c1-28(2,3)38-14-20-12-23(41-27(40-20)30(31,32)33)26(45)42-10-5-21(6-11-42)43-16-29(17-43,7-8-34)44-15-19(13-39-44)24-22-4-9-35-25(22)37-18-36-24/h4,9,12-13,15,18,21,38H,5-7,10-11,14,16-17H2,1-3H3,(H,35,36,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400625(US10695337, Example 381 | US11285140, Example 381 ...)
Show SMILES OCc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H25F3N10O2/c27-26(28,29)24-35-17(12-40)9-20(36-24)23(41)37-7-2-18(3-8-37)38-13-25(14-38,4-5-30)39-11-16(10-34-39)21-19-1-6-31-22(19)33-15-32-21/h1,6,9-11,15,18,40H,2-4,7-8,12-14H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400626(US10695337, Example 382 | US11285140, Example 382 ...)
Show SMILES CC(C)NCc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C29H32F3N11O/c1-18(2)35-13-20-11-23(40-27(39-20)29(30,31)32)26(44)41-9-4-21(5-10-41)42-15-28(16-42,6-7-33)43-14-19(12-38-43)24-22-3-8-34-25(22)37-17-36-24/h3,8,11-12,14,17-18,21,35H,4-6,9-10,13,15-16H2,1-2H3,(H,34,36,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400627(US10695337, Example 383 | US11285140, Example 383 ...)
Show SMILES CCNCc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H30F3N11O/c1-2-33-13-19-11-22(39-26(38-19)28(29,30)31)25(43)40-9-4-20(5-10-40)41-15-27(16-41,6-7-32)42-14-18(12-37-42)23-21-3-8-34-24(21)36-17-35-23/h3,8,11-12,14,17,20,33H,2,4-6,9-10,13,15-16H2,1H3,(H,34,35,36)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400628(US10695337, Example 384 | US11285140, Example 384 ...)
Show SMILES COCCN(C)Cc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C30H34F3N11O2/c1-41(11-12-46-2)16-21-13-24(40-28(39-21)30(31,32)33)27(45)42-9-4-22(5-10-42)43-17-29(18-43,6-7-34)44-15-20(14-38-44)25-23-3-8-35-26(23)37-19-36-25/h3,8,13-15,19,22H,4-6,9-12,16-18H2,1-2H3,(H,35,36,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400629(US10695337, Example 385 | US11285140, Example 385 ...)
Show SMILES CN(CCCO)Cc1cc(nc(n1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C30H34F3N11O2/c1-41(9-2-12-45)16-21-13-24(40-28(39-21)30(31,32)33)27(46)42-10-4-22(5-11-42)43-17-29(18-43,6-7-34)44-15-20(14-38-44)25-23-3-8-35-26(23)37-19-36-25/h3,8,13-15,19,22,45H,2,4-6,9-12,16-18H2,1H3,(H,35,36,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400630(Propyl 4-{3-(cyanomethyl)-3-[4-(7H-pyrrolo[2,3-d]p...)
Show SMILES CCCOC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C23H28N8O2/c1-2-11-33-22(32)29-9-4-18(5-10-29)30-14-23(15-30,6-7-24)31-13-17(12-28-31)20-19-3-8-25-21(19)27-16-26-20/h3,8,12-13,16,18H,2,4-6,9-11,14-15H2,1H3,(H,25,26,27)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400631(Cyclobutylmethyl 4-{3-(cyanomethyl)-3-[4-(7H-pyrro...)
Show SMILES O=C(OCC1CCC1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C25H30N8O2/c26-8-7-25(33-13-19(12-30-33)22-21-4-9-27-23(21)29-17-28-22)15-32(16-25)20-5-10-31(11-6-20)24(34)35-14-18-2-1-3-18/h4,9,12-13,17-18,20H,1-3,5-7,10-11,14-16H2,(H,27,28,29)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400633(US10695337, Example 389 | US11285140, Example 389 ...)
Show SMILES O=C(OCc1ccccc1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H28N8O2/c28-10-9-27(35-15-21(14-32-35)24-23-6-11-29-25(23)31-19-30-24)17-34(18-27)22-7-12-33(13-8-22)26(36)37-16-20-4-2-1-3-5-20/h1-6,11,14-15,19,22H,7-9,12-13,16-18H2,(H,29,30,31)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400634(US10695337, Example 390 | US11285140, Example 390 ...)
Show SMILES CC(C)COC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C24H30N8O2/c1-17(2)13-34-23(33)30-9-4-19(5-10-30)31-14-24(15-31,6-7-25)32-12-18(11-29-32)21-20-3-8-26-22(20)28-16-27-21/h3,8,11-12,16-17,19H,4-6,9-10,13-15H2,1-2H3,(H,26,27,28)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400637(2,4-difluorobenzyl 4-{3- (cyanomethyl)-3-[4-(7H- p...)
Show SMILES Fc1ccc(COC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c(F)c1
Show InChI InChI=1S/C27H26F2N8O2/c28-20-2-1-18(23(29)11-20)14-39-26(38)35-9-4-21(5-10-35)36-15-27(16-36,6-7-30)37-13-19(12-34-37)24-22-3-8-31-25(22)33-17-32-24/h1-3,8,11-13,17,21H,4-6,9-10,14-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400639(3,5-difluorobenzyl 4-{3- (cyanomethyl)-3-[4-(7H- p...)
Show SMILES Fc1cc(F)cc(COC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C27H26F2N8O2/c28-20-9-18(10-21(29)11-20)14-39-26(38)35-7-2-22(3-8-35)36-15-27(16-36,4-5-30)37-13-19(12-34-37)24-23-1-6-31-25(23)33-17-32-24/h1,6,9-13,17,22H,2-4,7-8,14-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400640(US10695337, Example 396 | US11285140, Example 396 ...)
Show SMILES O=C(OCC1CCCC1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H32N8O2/c27-9-8-26(34-14-20(13-31-34)23-22-5-10-28-24(22)30-18-29-23)16-33(17-26)21-6-11-32(12-7-21)25(35)36-15-19-3-1-2-4-19/h5,10,13-14,18-19,21H,1-4,6-8,11-12,15-17H2,(H,28,29,30)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400641(US10695337, Example 397 | US11285140, Example 397 ...)
Show SMILES O=C(OCC1CCCCC1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H34N8O2/c28-10-9-27(35-15-21(14-32-35)24-23-6-11-29-25(23)31-19-30-24)17-34(18-27)22-7-12-33(13-8-22)26(36)37-16-20-4-2-1-3-5-20/h6,11,14-15,19-20,22H,1-5,7-9,12-13,16-18H2,(H,29,30,31)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400518(US10695337, Example 274 | US11285140, Example 274 ...)
Show SMILES Fc1cc(cc(c1)C(F)(F)F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H25F4N7O/c29-21-12-19(11-20(13-21)28(30,31)32)26(40)37-8-3-22(4-9-37)38-15-27(16-38,5-6-33)39-10-2-18(14-39)24-23-1-7-34-25(23)36-17-35-24/h1-2,7,10-14,17,22H,3-5,8-9,15-16H2,(H,34,35,36)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400520(US10695337, Example 276 | US11285140, Example 276 ...)
Show SMILES Fc1cccc(C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c1F
Show InChI InChI=1S/C27H25F2N7O/c28-22-3-1-2-20(23(22)29)26(37)34-11-6-19(7-12-34)35-15-27(16-35,8-9-30)36-13-5-18(14-36)24-21-4-10-31-25(21)33-17-32-24/h1-5,10,13-14,17,19H,6-8,11-12,15-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400521(US10695337, Example 277 | US11285140, Example 277 ...)
Show SMILES Fc1ccc(cc1F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H25F2N7O/c28-22-2-1-18(13-23(22)29)26(37)34-10-5-20(6-11-34)35-15-27(16-35,7-8-30)36-12-4-19(14-36)24-21-3-9-31-25(21)33-17-32-24/h1-4,9,12-14,17,20H,5-7,10-11,15-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400522(US10695337, Example 278 | US11285140, Example 278 ...)
Show SMILES Fc1ccc(F)c(c1)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H25F2N7O/c28-19-1-2-23(29)22(13-19)26(37)34-10-5-20(6-11-34)35-15-27(16-35,7-8-30)36-12-4-18(14-36)24-21-3-9-31-25(21)33-17-32-24/h1-4,9,12-14,17,20H,5-7,10-11,15-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400523(US10695337, Example 279 | US11285140, Example 279 ...)
Show SMILES Fc1cccc(F)c1C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H25F2N7O/c28-21-2-1-3-22(29)23(21)26(37)34-11-6-19(7-12-34)35-15-27(16-35,8-9-30)36-13-5-18(14-36)24-20-4-10-31-25(20)33-17-32-24/h1-5,10,13-14,17,19H,6-8,11-12,15-16H2,(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400524(US10695337, Example 280 | US11285140, Example 280 ...)
Show SMILES Fc1ccc(C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c(F)c1F
Show InChI InChI=1S/C27H24F3N7O/c28-21-2-1-19(22(29)23(21)30)26(38)35-10-5-18(6-11-35)36-14-27(15-36,7-8-31)37-12-4-17(13-37)24-20-3-9-32-25(20)34-16-33-24/h1-4,9,12-13,16,18H,5-7,10-11,14-15H2,(H,32,33,34)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400525(US10695337, Example 281 | US11285140, Example 281 ...)
Show SMILES Fc1c(OC(F)(F)F)cccc1C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H25F4N7O2/c29-23-20(2-1-3-22(23)41-28(30,31)32)26(40)37-11-6-19(7-12-37)38-15-27(16-38,8-9-33)39-13-5-18(14-39)24-21-4-10-34-25(21)36-17-35-24/h1-5,10,13-14,17,19H,6-8,11-12,15-16H2,(H,34,35,36)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400527(4-{3-(Cyanomethyl)-3-[3-(7H-pyrrolo[2,3-d]pyrimidi...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c(c1)C(F)(F)F
Show InChI InChI=1S/C28H26F4N8O/c29-19-1-2-23(22(13-19)28(30,31)32)37-26(41)38-10-5-20(6-11-38)39-15-27(16-39,7-8-33)40-12-4-18(14-40)24-21-3-9-34-25(21)36-17-35-24/h1-4,9,12-14,17,20H,5-7,10-11,15-16H2,(H,37,41)(H,34,35,36)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400528(US10695337, Example 284 | US11285140, Example 284 ...)
Show SMILES COc1ncccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H29N9O2/c1-38-25-22(3-2-10-30-25)33-26(37)34-12-6-20(7-13-34)35-16-27(17-35,8-9-28)36-14-5-19(15-36)23-21-4-11-29-24(21)32-18-31-23/h2-5,10-11,14-15,18,20H,6-8,12-13,16-17H2,1H3,(H,33,37)(H,29,31,32)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM448720(4-{3-(cyanomethyl)-3-[3-(7H- pyrrolo[2,3-d]pyrimid...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c(F)c1
Show InChI InChI=1S/C27H26F2N8O/c28-19-1-2-23(22(29)13-19)34-26(38)35-10-5-20(6-11-35)36-15-27(16-36,7-8-30)37-12-4-18(14-37)24-21-3-9-31-25(21)33-17-32-24/h1-4,9,12-14,17,20H,5-7,10-11,15-16H2,(H,34,38)(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand Info
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400532(US10695337, Example 288 | US11285140, Example 288 ...)
Show SMILES COc1ccccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H30N8O2/c1-38-24-5-3-2-4-23(24)33-27(37)34-13-8-21(9-14-34)35-17-28(18-35,10-11-29)36-15-7-20(16-36)25-22-6-12-30-26(22)32-19-31-25/h2-7,12,15-16,19,21H,8-10,13-14,17-18H2,1H3,(H,33,37)(H,30,31,32)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400533(US10695337, Example 289 | US11285140, Example 289 ...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c(Cl)c1
Show InChI InChI=1S/C27H26ClFN8O/c28-22-13-19(29)1-2-23(22)34-26(38)35-10-5-20(6-11-35)36-15-27(16-36,7-8-30)37-12-4-18(14-37)24-21-3-9-31-25(21)33-17-32-24/h1-4,9,12-14,17,20H,5-7,10-11,15-16H2,(H,34,38)(H,31,32,33)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400535(US10695337, Example 291 | US11285140, Example 165 ...)
Show SMILES FC(F)(F)c1ccncc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H26F3N9O/c28-27(29,30)21-2-8-32-13-22(21)36-25(40)37-10-4-19(5-11-37)38-15-26(16-38,6-7-31)39-12-3-18(14-39)23-20-1-9-33-24(20)35-17-34-23/h1-3,8-9,12-14,17,19H,4-6,10-11,15-16H2,(H,36,40)(H,33,34,35)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400536(US10695337, Example 292 | US11285140, Example 292 ...)
Show SMILES Fc1cccnc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H26FN9O/c27-21-2-1-9-29-24(21)33-25(37)34-11-5-19(6-12-34)35-15-26(16-35,7-8-28)36-13-4-18(14-36)22-20-3-10-30-23(20)32-17-31-22/h1-4,9-10,13-14,17,19H,5-7,11-12,15-16H2,(H,29,33,37)(H,30,31,32)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400537(US10695337, Example 293 | US11285140, Example 293 ...)
Show SMILES Clc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c(c1)C#N
Show InChI InChI=1S/C28H26ClN9O/c29-21-1-2-24(20(13-21)14-31)35-27(39)36-10-5-22(6-11-36)37-16-28(17-37,7-8-30)38-12-4-19(15-38)25-23-3-9-32-26(23)34-18-33-25/h1-4,9,12-13,15,18,22H,5-7,10-11,16-17H2,(H,35,39)(H,32,33,34)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400540(US11285140, Example 296 | US9999619, Example 296)
Show SMILES Oc1ccc(cc1F)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C27H26FN7O2/c28-23-13-18(1-2-24(23)36)26(37)33-11-5-20(6-12-33)34-16-27(17-34,7-8-29)35-15-19(14-32-35)21-3-9-30-25-22(21)4-10-31-25/h1-4,9-10,13-15,20,36H,5-7,11-12,16-17H2,(H,30,31)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400541(US10695337, Example 297 | US11285140, Example 297 ...)
Show SMILES Oc1ccc(C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ccnc3[nH]ccc23)c(F)c1
Show InChI InChI=1S/C27H26FN7O2/c28-24-13-20(36)1-2-23(24)26(37)33-11-5-19(6-12-33)34-16-27(17-34,7-8-29)35-15-18(14-32-35)21-3-9-30-25-22(21)4-10-31-25/h1-4,9-10,13-15,19,36H,5-7,11-12,16-17H2,(H,30,31)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400547(4-{3-(Cyanomethyl)-3-[4-(1H-pyrrolo[2,3-b]pyridin-...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ccnc3[nH]ccc23)c(c1)C(F)(F)F
Show InChI InChI=1S/C28H26F4N8O/c29-19-1-2-24(23(13-19)28(30,31)32)37-26(41)38-11-5-20(6-12-38)39-16-27(17-39,7-8-33)40-15-18(14-36-40)21-3-9-34-25-22(21)4-10-35-25/h1-4,9-10,13-15,20H,5-7,11-12,16-17H2,(H,34,35)(H,37,41)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400548(US10695337, Example 304 | US11285140, Example 304 ...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ccnc3[nH]ccc23)c(F)c1
Show InChI InChI=1S/C27H26F2N8O/c28-19-1-2-24(23(29)13-19)34-26(38)35-11-5-20(6-12-35)36-16-27(17-36,7-8-30)37-15-18(14-33-37)21-3-9-31-25-22(21)4-10-32-25/h1-4,9-10,13-15,20H,5-7,11-12,16-17H2,(H,31,32)(H,34,38)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400549(US10695337, Example 305 | US11285140, Example 305 ...)
Show SMILES Fc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ccnc3[nH]ccc23)c(Cl)c1
Show InChI InChI=1S/C27H26ClFN8O/c28-23-13-19(29)1-2-24(23)34-26(38)35-11-5-20(6-12-35)36-16-27(17-36,7-8-30)37-15-18(14-33-37)21-3-9-31-25-22(21)4-10-32-25/h1-4,9-10,13-15,20H,5-7,11-12,16-17H2,(H,31,32)(H,34,38)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400552(US10695337, Example 308 | US11285140, Example 308 ...)
Show SMILES FC(F)(F)c1ccncc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C27H26F3N9O/c28-27(29,30)22-3-8-32-14-23(22)36-25(40)37-11-4-19(5-12-37)38-16-26(17-38,6-7-31)39-15-18(13-35-39)20-1-9-33-24-21(20)2-10-34-24/h1-3,8-10,13-15,19H,4-6,11-12,16-17H2,(H,33,34)(H,36,40)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400554(US10695337, Example 310 | US11285140, Example 310 ...)
Show SMILES Clc1ccccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12
Show InChI InChI=1S/C27H27ClN8O/c28-23-3-1-2-4-24(23)33-26(37)34-13-7-20(8-14-34)35-17-27(18-35,9-10-29)36-16-19(15-32-36)21-5-11-30-25-22(21)6-12-31-25/h1-6,11-12,15-16,20H,7-9,13-14,17-18H2,(H,30,31)(H,33,37)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400557(US10695337, Example 313 | US11285140, Example 313 ...)
Show SMILES Clc1cc(ccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ccnc2[nH]ccc12)C#N
Show InChI InChI=1S/C28H26ClN9O/c29-24-13-19(14-31)1-2-25(24)35-27(39)36-11-5-21(6-12-36)37-17-28(18-37,7-8-30)38-16-20(15-34-38)22-3-9-32-26-23(22)4-10-33-26/h1-4,9-10,13,15-16,21H,5-7,11-12,17-18H2,(H,32,33)(H,35,39)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400558((3-[4-(5-Fluoro-1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-...)
Show SMILES Fc1cnc2[nH]ccc2c1-c1cnn(c1)C1(CC#N)CN(C1)C1CCN(CC1)C(=O)c1ccnc(c1F)C(F)(F)F
Show InChI InChI=1S/C27H23F5N8O/c28-20-12-36-24-18(1-8-35-24)21(20)16-11-37-40(13-16)26(5-6-33)14-39(15-26)17-3-9-38(10-4-17)25(41)19-2-7-34-23(22(19)29)27(30,31)32/h1-2,7-8,11-13,17H,3-5,9-10,14-15H2,(H,35,36)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400560(US10695337, Example 316 | US11285140, Example 316 ...)
Show SMILES Fc1cc(cc(c1)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1c(F)cnc2[nH]ccc12)C#N
Show InChI InChI=1S/C28H24F2N8O/c29-21-10-18(12-32)9-19(11-21)27(39)36-7-2-22(3-8-36)37-16-28(17-37,4-5-31)38-15-20(13-35-38)25-23-1-6-33-26(23)34-14-24(25)30/h1,6,9-11,13-15,22H,2-4,7-8,16-17H2,(H,33,34)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation

US Patent
LigandPNGBDBM400561(US10695337, Example 317 | US11285140, Example 317 ...)
Show SMILES Fc1cc(ccc1C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1c(F)cnc2[nH]ccc12)C#N
Show InChI InChI=1S/C28H24F2N8O/c29-23-11-18(12-32)1-2-21(23)27(39)36-9-4-20(5-10-36)37-16-28(17-37,6-7-31)38-15-19(13-35-38)25-22-3-8-33-26(22)34-14-24(25)30/h1-3,8,11,13-15,20H,4-6,9-10,16-17H2,(H,33,34)
Affinity DataIC50: 5nMAssay Description:Compounds herein were tested for inhibitory activity of JAK targets according to the following in vitro assay described in Park et al., Analytical Bi...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
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