Compile Data Set for Download or QSAR
Found 794 Enz. Inhib. hit(s) with all data for entry = 10521
TargetTyrosine-protein kinase JAK1 [837-1142](Homo sapiens (Human))
Incyte Corporation; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400422(US10695337, Example 177 | US11285140, Example 177 ...)
Show SMILES Fc1c(Cl)cccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H25ClFN9O/c27-20-2-1-3-21(22(20)28)34-25(38)35-10-5-18(6-11-35)36-14-26(15-36,7-8-29)37-13-17(12-33-37)23-19-4-9-30-24(19)32-16-31-23/h1-4,9,12-13,16,18H,5-7,10-11,14-15H2,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400423(US10695337, Example 178 | US11285140, Example 178 ...)
Show SMILES Fc1cc(Cl)ccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H25ClFN9O/c27-18-1-2-22(21(28)11-18)34-25(38)35-9-4-19(5-10-35)36-14-26(15-36,6-7-29)37-13-17(12-33-37)23-20-3-8-30-24(20)32-16-31-23/h1-3,8,11-13,16,19H,4-6,9-10,14-15H2,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400425(US10695337, Example 180 | US11285140, Example 180 ...)
Show SMILES COc1ccccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H29N9O2/c1-38-23-5-3-2-4-22(23)33-26(37)34-12-7-20(8-13-34)35-16-27(17-35,9-10-28)36-15-19(14-32-36)24-21-6-11-29-25(21)31-18-30-24/h2-6,11,14-15,18,20H,7-9,12-13,16-17H2,1H3,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400426(US10695337, Example 181 | US11285140, Example 181 ...)
Show SMILES COc1cccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C27H29N9O2/c1-38-22-4-2-3-20(13-22)33-26(37)34-11-6-21(7-12-34)35-16-27(17-35,8-9-28)36-15-19(14-32-36)24-23-5-10-29-25(23)31-18-30-24/h2-5,10,13-15,18,21H,6-8,11-12,16-17H2,1H3,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400428(US10695337, Example 183 | US11285140, Example 183 ...)
Show SMILES Clc1cccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C26H26ClN9O/c27-19-2-1-3-20(12-19)33-25(37)34-10-5-21(6-11-34)35-15-26(16-35,7-8-28)36-14-18(13-32-36)23-22-4-9-29-24(22)31-17-30-23/h1-4,9,12-14,17,21H,5-7,10-11,15-16H2,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400429(US10695337, Example 184 | US11285140, Example 184 ...)
Show SMILES Clc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)cc1
Show InChI InChI=1S/C26H26ClN9O/c27-19-1-3-20(4-2-19)33-25(37)34-11-6-21(7-12-34)35-15-26(16-35,8-9-28)36-14-18(13-32-36)23-22-5-10-29-24(22)31-17-30-23/h1-5,10,13-14,17,21H,6-8,11-12,15-16H2,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400430(US11285140, Example 185 | US9999619, Example 185)
Show SMILES Cc1ccccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H29N9O/c1-19-4-2-3-5-23(19)33-26(37)34-12-7-21(8-13-34)35-16-27(17-35,9-10-28)36-15-20(14-32-36)24-22-6-11-29-25(22)31-18-30-24/h2-6,11,14-15,18,21H,7-9,12-13,16-17H2,1H3,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400431(US10695337, Example 186 | US11285140, Example 186 ...)
Show SMILES COc1ccc(OC)c(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C28H31N9O3/c1-39-21-3-4-24(40-2)23(13-21)34-27(38)35-11-6-20(7-12-35)36-16-28(17-36,8-9-29)37-15-19(14-33-37)25-22-5-10-30-26(22)32-18-31-25/h3-5,10,13-15,18,20H,6-8,11-12,16-17H2,1-2H3,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400432(US10695337, Example 187 | US11285140, Example 187 ...)
Show SMILES Cc1cc(F)ccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H28FN9O/c1-18-12-20(28)2-3-23(18)34-26(38)35-10-5-21(6-11-35)36-15-27(16-36,7-8-29)37-14-19(13-33-37)24-22-4-9-30-25(22)32-17-31-24/h2-4,9,12-14,17,21H,5-7,10-11,15-16H2,1H3,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400438(US10695337, Example 193 | US11285140, Example 193 ...)
Show SMILES O=C(Nc1nc2ccccc2s1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C27H26N10OS/c28-9-8-27(37-14-18(13-32-37)23-20-5-10-29-24(20)31-17-30-23)15-36(16-27)19-6-11-35(12-7-19)26(38)34-25-33-21-3-1-2-4-22(21)39-25/h1-5,10,13-14,17,19H,6-8,11-12,15-16H2,(H,29,30,31)(H,33,34,38)
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400439(US10695337, Example 194 | US11285140, Example 194 ...)
Show SMILES Cn1c(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)nc2ccccc12
Show InChI InChI=1S/C28H29N11O/c1-36-23-5-3-2-4-22(23)34-26(36)35-27(40)37-12-7-20(8-13-37)38-16-28(17-38,9-10-29)39-15-19(14-33-39)24-21-6-11-30-25(21)32-18-31-24/h2-6,11,14-15,18,20H,7-9,12-13,16-17H2,1H3,(H,30,31,32)(H,34,35,40)
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400443(US10695337, Example 198 | US11285140, Example 198 ...)
Show SMILES Cc1ncccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H28N10O/c1-18-22(3-2-9-28-18)33-25(37)34-11-5-20(6-12-34)35-15-26(16-35,7-8-27)36-14-19(13-32-36)23-21-4-10-29-24(21)31-17-30-23/h2-4,9-10,13-14,17,20H,5-7,11-12,15-16H2,1H3,(H,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400444(US10695337, Example 199 | US11285140, Example 199 ...)
Show SMILES Cc1nc(F)ccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H27FN10O/c1-17-21(2-3-22(27)33-17)34-25(38)35-10-5-19(6-11-35)36-14-26(15-36,7-8-28)37-13-18(12-32-37)23-20-4-9-29-24(20)31-16-30-23/h2-4,9,12-13,16,19H,5-7,10-11,14-15H2,1H3,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400445(US10695337, Example 200 | US11285140, Example 200 ...)
Show SMILES Cc1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c(F)n1
Show InChI InChI=1S/C26H27FN10O/c1-17-2-3-21(23(27)33-17)34-25(38)35-10-5-19(6-11-35)36-14-26(15-36,7-8-28)37-13-18(12-32-37)22-20-4-9-29-24(20)31-16-30-22/h2-4,9,12-13,16,19H,5-7,10-11,14-15H2,1H3,(H,34,38)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400447(US10695337, Example 202 | US11285140, Example 202 ...)
Show SMILES Fc1cccnc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C25H25FN10O/c26-20-2-1-8-28-23(20)33-24(37)34-10-4-18(5-11-34)35-14-25(15-35,6-7-27)36-13-17(12-32-36)21-19-3-9-29-22(19)31-16-30-21/h1-3,8-9,12-13,16,18H,4-6,10-11,14-15H2,(H,28,33,37)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400449(US10695337, Example 204 | US11285140, Example 204 ...)
Show SMILES COc1ncccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H28N10O2/c1-38-24-21(3-2-9-29-24)33-25(37)34-11-5-19(6-12-34)35-15-26(16-35,7-8-27)36-14-18(13-32-36)22-20-4-10-28-23(20)31-17-30-22/h2-4,9-10,13-14,17,19H,5-7,11-12,15-16H2,1H3,(H,33,37)(H,28,30,31)
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400451(US10695337, Example 206 | US11285140, Example 206 ...)
Show SMILES COC(=O)c1ccccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H29N9O3/c1-40-26(38)21-4-2-3-5-23(21)34-27(39)35-12-7-20(8-13-35)36-16-28(17-36,9-10-29)37-15-19(14-33-37)24-22-6-11-30-25(22)32-18-31-24/h2-6,11,14-15,18,20H,7-9,12-13,16-17H2,1H3,(H,34,39)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400452(US10695337, Example 207 | US11285140, Example 207 ...)
Show SMILES COC(=O)c1cc(F)ccc1NC(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H28FN9O3/c1-41-26(39)22-12-19(29)2-3-23(22)35-27(40)36-10-5-20(6-11-36)37-15-28(16-37,7-8-30)38-14-18(13-34-38)24-21-4-9-31-25(21)33-17-32-24/h2-4,9,12-14,17,20H,5-7,10-11,15-16H2,1H3,(H,35,40)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400453(US10695337, Example 208 | US11285140, Example 208 ...)
Show SMILES COC(=O)c1ccc(NC(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c(F)c1
Show InChI InChI=1S/C28H28FN9O3/c1-41-26(39)18-2-3-23(22(29)12-18)35-27(40)36-10-5-20(6-11-36)37-15-28(16-37,7-8-30)38-14-19(13-34-38)24-21-4-9-31-25(21)33-17-32-24/h2-4,9,12-14,17,20H,5-7,10-11,15-16H2,1H3,(H,35,40)(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400454(3-[(4-{3-(Cyanomethyl)-3-[4-(7H-pyrrolo[2,3-d]pyri...)
Show SMILES CN(C)c1ccc(CN2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c(F)c1C#N
Show InChI InChI=1S/C29H31FN10/c1-37(2)25-4-3-20(26(30)24(25)13-32)15-38-11-6-22(7-12-38)39-17-29(18-39,8-9-31)40-16-21(14-36-40)27-23-5-10-33-28(23)35-19-34-27/h3-5,10,14,16,19,22H,6-8,11-12,15,17-18H2,1-2H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400455(US10695337, Example 210 | US11285140, Example 210 ...)
Show SMILES Clc1cc(Cl)cc(CN2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C26H26Cl2N8/c27-20-9-18(10-21(28)11-20)13-34-7-2-22(3-8-34)35-15-26(16-35,4-5-29)36-14-19(12-33-36)24-23-1-6-30-25(23)32-17-31-24/h1,6,9-12,14,17,22H,2-4,7-8,13,15-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400458(US10695337, Example 213 | US11285140, Example 213 ...)
Show SMILES Fc1cccc(c1CN1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12)C(F)(F)F
Show InChI InChI=1S/C27H26F4N8/c28-23-3-1-2-22(27(29,30)31)21(23)14-37-10-5-19(6-11-37)38-15-26(16-38,7-8-32)39-13-18(12-36-39)24-20-4-9-33-25(20)35-17-34-24/h1-4,9,12-13,17,19H,5-7,10-11,14-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400460(US10695337, Example 215 | US11285140, Example 215 ...)
Show SMILES Fc1cc(F)cc(CN2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1
Show InChI InChI=1S/C26H26F2N8/c27-20-9-18(10-21(28)11-20)13-34-7-2-22(3-8-34)35-15-26(16-35,4-5-29)36-14-19(12-33-36)24-23-1-6-30-25(23)32-17-31-24/h1,6,9-12,14,17,22H,2-4,7-8,13,15-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400470(US10695337, Example 225 | US11285140, Example 225 ...)
Show SMILES Brc1cc(CN2CCC(CC2)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)cc(Br)n1
Show InChI InChI=1S/C25H25Br2N9/c26-21-9-17(10-22(27)33-21)12-34-7-2-19(3-8-34)35-14-25(15-35,4-5-28)36-13-18(11-32-36)23-20-1-6-29-24(20)31-16-30-23/h1,6,9-11,13,16,19H,2-4,7-8,12,14-15H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400472(US10695337, Example 227 | US11285140, Example 227 ...)
Show SMILES Fc1cccc(Cl)c1CN1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H26ClFN8/c27-22-2-1-3-23(28)21(22)14-34-10-5-19(6-11-34)35-15-26(16-35,7-8-29)36-13-18(12-33-36)24-20-4-9-30-25(20)32-17-31-24/h1-4,9,12-13,17,19H,5-7,10-11,14-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400473(US10695337, Example 228 | US11285140, Example 228 ...)
Show SMILES Fc1ccc(Cl)c(F)c1CN1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C26H25ClF2N8/c27-21-1-2-22(28)20(23(21)29)13-35-9-4-18(5-10-35)36-14-26(15-36,6-7-30)37-12-17(11-34-37)24-19-3-8-31-25(19)33-16-32-24/h1-3,8,11-12,16,18H,4-6,9-10,13-15H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400479(US10695337, Example 234 | US11285140, Example 234 ...)
Show SMILES N#CCC1(CN(C1)C1CCN(Cc2ccc3OCCOc3c2)CC1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H30N8O2/c29-7-6-28(36-16-21(14-33-36)26-23-3-8-30-27(23)32-19-31-26)17-35(18-28)22-4-9-34(10-5-22)15-20-1-2-24-25(13-20)38-12-11-37-24/h1-3,8,13-14,16,19,22H,4-6,9-12,15,17-18H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400481(US10695337, Example 236 | US11285140, Example 236 ...)
Show SMILES Fc1c(Cl)ccc(c1CN1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12)C(F)(F)F
Show InChI InChI=1S/C27H25ClF4N8/c28-22-2-1-21(27(30,31)32)20(23(22)29)13-38-9-4-18(5-10-38)39-14-26(15-39,6-7-33)40-12-17(11-37-40)24-19-3-8-34-25(19)36-16-35-24/h1-3,8,11-12,16,18H,4-6,9-10,13-15H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400483(US10695337, Example 238 | US11285140, Example 238 ...)
Show SMILES COc1ccc2nc(Cl)c(CN3CCC(CC3)N3CC(CC#N)(C3)n3cc(cn3)-c3ncnc4[nH]ccc34)cc2c1
Show InChI InChI=1S/C30H30ClN9O/c1-41-24-2-3-26-20(13-24)12-21(28(31)37-26)15-38-10-5-23(6-11-38)39-17-30(18-39,7-8-32)40-16-22(14-36-40)27-25-4-9-33-29(25)35-19-34-27/h2-4,9,12-14,16,19,23H,5-7,10-11,15,17-18H2,1H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400485(3-[(3-{3-(Cyanomethyl)-3-[4-(7H-pyrrolo[2,3-d]pyri...)
Show SMILES CN(C)c1ccc(CN2C3CCC2CC(C3)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c(F)c1C#N
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400486(US10695337, Example 241 | US11285140, Example 241 ...)
Show SMILES Fc1ccc(F)c(CN2C3CCC2CC(C3)N2CC(CC#N)(C2)n2cc(cn2)-c2ncnc3[nH]ccc23)c1Cl
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400487(Diastereomers of 3-[(4-{3-(cyanomethyl)-3-[4-(7H-p...)
Show SMILES C[C@@H]1CC(CCN1Cc1ccc(N(C)C)c(C#N)c1F)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400490(US10695337, Example 246 | US11285140, Example 246 ...)
Show SMILES Cn1nccc1S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C23H26N10O2S/c1-30-20(3-9-28-30)36(34,35)32-10-4-18(5-11-32)31-14-23(15-31,6-7-24)33-13-17(12-29-33)21-19-2-8-25-22(19)27-16-26-21/h2-3,8-9,12-13,16,18H,4-6,10-11,14-15H2,1H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400491(US10695337, Example 247 | US11285140, Example 247 ...)
Show SMILES O=S(=O)(N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12)c1ccccc1C#N
Show InChI InChI=1S/C26H25N9O2S/c27-9-8-26(35-15-20(14-32-35)24-22-5-10-29-25(22)31-18-30-24)16-33(17-26)21-6-11-34(12-7-21)38(36,37)23-4-2-1-3-19(23)13-28/h1-5,10,14-15,18,21H,6-8,11-12,16-17H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400494(US10695337, Example 250 | US11285140, Example 250 ...)
Show SMILES CN(C)c1ccc(cc1C#N)S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H30N10O2S/c1-35(2)25-4-3-23(13-20(25)14-30)41(39,40)37-11-6-22(7-12-37)36-17-28(18-36,8-9-29)38-16-21(15-34-38)26-24-5-10-31-27(24)33-19-32-26/h3-5,10,13,15-16,19,22H,6-8,11-12,17-18H2,1-2H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400495(US10695337, Example 251 | US11285140, Example 251 ...)
Show SMILES Cn1ccc(n1)S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C23H26N10O2S/c1-30-9-5-20(29-30)36(34,35)32-10-3-18(4-11-32)31-14-23(15-31,6-7-24)33-13-17(12-28-33)21-19-2-8-25-22(19)27-16-26-21/h2,5,8-9,12-13,16,18H,3-4,6,10-11,14-15H2,1H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400497(US10695337, Example 253 | US11285140, Example 253 ...)
Show SMILES O=S(=O)(C1CCCC1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C24H30N8O2S/c25-9-8-24(32-14-18(13-29-32)22-21-5-10-26-23(21)28-17-27-22)15-30(16-24)19-6-11-31(12-7-19)35(33,34)20-3-1-2-4-20/h5,10,13-14,17,19-20H,1-4,6-8,11-12,15-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400498(US11285140, Example 254 | US9999619, Example 254 |...)
Show SMILES CS(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C20H24N8O2S/c1-31(29,30)27-8-3-16(4-9-27)26-12-20(13-26,5-6-21)28-11-15(10-25-28)18-17-2-7-22-19(17)24-14-23-18/h2,7,10-11,14,16H,3-5,8-9,12-13H2,1H3,(H,22,23,24)
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400500(US10695337, Example 256 | US11285140, Example 256 ...)
Show SMILES O=S(=O)(C1CC1)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C22H26N8O2S/c23-7-6-22(30-12-16(11-27-30)20-19-3-8-24-21(19)26-15-25-20)13-28(14-22)17-4-9-29(10-5-17)33(31,32)18-1-2-18/h3,8,11-12,15,17-18H,1-2,4-6,9-10,13-14H2,(H,24,25,26)
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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400502(US10695337, Example 258 | US11285140, Example 258 ...)
Show SMILES Cn1cnc(c1)S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C23H26N10O2S/c1-30-12-20(28-16-30)36(34,35)32-8-3-18(4-9-32)31-13-23(14-31,5-6-24)33-11-17(10-29-33)21-19-2-7-25-22(19)27-15-26-21/h2,7,10-12,15-16,18H,3-5,8-9,13-14H2,1H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400503(US10695337, Example 259 | US11285140, Example 259 ...)
Show SMILES Cc1nc(cn1C)S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C24H28N10O2S/c1-17-30-21(13-31(17)2)37(35,36)33-9-4-19(5-10-33)32-14-24(15-32,6-7-25)34-12-18(11-29-34)22-20-3-8-26-23(20)28-16-27-22/h3,8,11-13,16,19H,4-6,9-10,14-15H2,1-2H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400504(US10695337, Example 260 | US11285140, Example 260 ...)
Show SMILES Cc1noc(C)c1S(=O)(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1cc(cn1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C24H27N9O3S/c1-16-22(17(2)36-30-16)37(34,35)32-9-4-19(5-10-32)31-13-24(14-31,6-7-25)33-12-18(11-29-33)21-20-3-8-26-23(20)28-15-27-21/h3,8,11-12,15,19H,4-6,9-10,13-14H2,1-2H3,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400507(US10695337, Example 263 | US11285140, Example 263 ...)
Show SMILES Fc1cc(cc(c1)C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12)C#N
Show InChI InChI=1S/C28H25FN8O/c29-22-12-19(14-31)11-21(13-22)27(38)35-8-3-23(4-9-35)36-16-28(17-36,5-6-30)37-10-2-20(15-37)25-24-1-7-32-26(24)34-18-33-25/h1-2,7,10-13,15,18,23H,3-5,8-9,16-17H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400513(US11285140, Example 269 | US9999619, Example 269)
Show SMILES Fc1ccc(OC(F)(F)F)cc1C(=O)N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12
Show InChI InChI=1S/C28H25F4N7O2/c29-23-2-1-20(41-28(30,31)32)13-22(23)26(40)37-10-5-19(6-11-37)38-15-27(16-38,7-8-33)39-12-4-18(14-39)24-21-3-9-34-25(21)36-17-35-24/h1-4,9,12-14,17,19H,5-7,10-11,15-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400514(US10695337, Example 270 | US11285140, Example 270 ...)
Show SMILES Fc1ccc(F)c(C(=O)N2CCC(CC2)N2CC(CC#N)(C2)n2ccc(c2)-c2ncnc3[nH]ccc23)c1F
Show InChI InChI=1S/C27H24F3N7O/c28-20-1-2-21(29)23(30)22(20)26(38)35-10-5-18(6-11-35)36-14-27(15-36,7-8-31)37-12-4-17(13-37)24-19-3-9-32-25(19)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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM400515(US10695337, Example 271 | US11285140, Example 271 ...)
Show SMILES O=C(N1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12)c1cccs1
Show InChI InChI=1S/C25H25N7OS/c26-8-7-25(32-12-4-18(14-32)22-20-3-9-27-23(20)29-17-28-22)15-31(16-25)19-5-10-30(11-6-19)24(33)21-2-1-13-34-21/h1-4,9,12-14,17,19H,5-7,10-11,15-16H2,(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; Incyte Holdings Cororation

US Patent
LigandPNGBDBM544275(US11285140, Example 273)
Show SMILES Fc1ccc(cc1CN1CCC(CC1)N1CC(CC#N)(C1)n1ccc(c1)-c1ncnc2[nH]ccc12)C(F)(F)F
Show InChI InChI=1S/C28H27F4N7/c29-24-2-1-21(28(30,31)32)13-20(24)14-37-10-5-22(6-11-37)38-16-27(17-38,7-8-33)39-12-4-19(15-39)25-23-3-9-34-26(23)36-18-35-25/h1-4,9,12-13,15,18,22H,5-7,10-11,14,16-17H2,(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; Incyte Holdings Cororation

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; Incyte Holdings Cororation

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; Incyte Holdings Cororation

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
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