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Patent code US10682352

Compile Data Set for Download or QSAR
Found 117 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445270
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(5-(3-(trifl...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccccc2Cl)n1
Show InChI InChI=1S/C23H26ClN7O/c1-15(2)18-12-29(3)22(32)31(18)20-8-11-25-21(27-20)28-23(9-10-23)19-13-30(14-26-19)17-7-5-4-6-16(17)24/h4-8,11,13-15,18H,9-10,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445288
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-9-10-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-16(23)6-8-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445306
PNG
((S)-3-(2-((1-(1-(3,5-difluoro-4-methylphenyl)-1H-i...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(F)c(C)c(F)c2)n1
Show InChI InChI=1S/C24H27F2N7O/c1-14(2)19-11-31(4)23(34)33(19)21-5-8-27-22(29-21)30-24(6-7-24)20-12-32(13-28-20)16-9-17(25)15(3)18(26)10-16/h5,8-10,12-14,19H,6-7,11H2,1-4H3,(H,27,29,30)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445327
PNG
((S)-3-(2-((1-(1-(3-bromo-5-fluorophenyl)-imidazol-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(F)cc(Br)c2)n1
Show InChI InChI=1S/C23H25BrFN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445344
PNG
((S)-3-(2-(((S)-1-(1-(3-chloro-5-fluorophenyl)-1H-i...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cc(F)cc(Cl)c2)n1
Show InChI InChI=1S/C22H25ClFN7O/c1-13(2)19-11-29(4)22(32)31(19)20-5-6-25-21(28-20)27-14(3)18-10-30(12-26-18)17-8-15(23)7-16(24)9-17/h5-10,12-14,19H,11H2,1-4H3,(H,25,27,28)/t14-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445345
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-14(2)19-12-31(4)22(34)33(19)20-9-10-27-21(30-20)29-15(3)18-11-32(13-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-11,13-15,19H,12H2,1-4H3,(H,27,29,30)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445380
PNG
((5S)-1-(2-(((S)-1-(1-(4-trifluoromethylphenyl)-1H-...)
Show SMILES CC(C)[C@H]1[C@H](C)NC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-13(2)20-15(4)30-22(34)33(20)19-9-10-27-21(31-19)29-14(3)18-11-32(12-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-15,20H,1-4H3,(H,30,34)(H,27,29,31)/t14-,15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445381
PNG
(US10682352, Compound 94)
Show SMILES CC(C)[C@H]1[C@@H](C)N(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C24H28F3N7O/c1-14(2)21-16(4)32(5)23(35)34(21)20-10-11-28-22(31-20)30-15(3)19-12-33(13-29-19)18-8-6-17(7-9-18)24(25,26)27/h6-16,21H,1-5H3,(H,28,30,31)/t15-,16+,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445392
PNG
((S)-8-isopropyl-7-(2-(((S)-1-(1-(4-trifluoromethyl...)
Show SMILES CC(C)[C@@H]1N(C(=O)NC11COC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C24H26F3N7O2/c1-14(2)20-23(11-36-12-23)32-22(35)34(20)19-8-9-28-21(31-19)30-15(3)18-10-33(13-29-18)17-6-4-16(5-7-17)24(25,26)27/h4-10,13-15,20H,11-12H2,1-3H3,(H,32,35)(H,28,30,31)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445393
PNG
((S)-8-isopropyl-5-methyl-7-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@@H]1N(C(=O)N(C)C11COC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C25H28F3N7O2/c1-15(2)21-24(12-37-13-24)33(4)23(36)35(21)20-9-10-29-22(32-20)31-16(3)19-11-34(14-30-19)18-7-5-17(6-8-18)25(26,27)28/h5-11,14-16,21H,12-13H2,1-4H3,(H,29,31,32)/t16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445403
PNG
((S)-4-isopropyl-1-trideuteromethyl-3-(2-(((S)-1-(5...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2ccc(cn2)-c2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C25H27F3N6O/c1-15(2)21-14-33(4)24(35)34(21)22-10-11-29-23(32-22)31-16(3)20-9-8-18(13-30-20)17-6-5-7-19(12-17)25(26,27)28/h5-13,15-16,21H,14H2,1-4H3,(H,29,31,32)/t16-,21+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445269
PNG
((S)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C21H24ClN7O/c1-13(2)18-10-24-21(30)29(18)19-8-9-23-20(27-19)26-14(3)17-11-28(12-25-17)16-6-4-15(22)5-7-16/h4-9,11-14,18H,10H2,1-3H3,(H,24,30)(H,23,26,27)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445294
PNG
((S)-5-isopropyl-1-(2-((1-(1-(m-tolyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(C)c2)n1
Show InChI InChI=1S/C23H27N7O/c1-15(2)18-12-25-22(31)30(18)20-7-10-24-21(27-20)28-23(8-9-23)19-13-29(14-26-19)17-6-4-5-16(3)11-17/h4-7,10-11,13-15,18H,8-9,12H2,1-3H3,(H,25,31)(H,24,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445303
PNG
((S)-3-(2-((1-(1-(3-isopropylphenyl)-1H-imidazol-4-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(c2)C(C)C)n1
Show InChI InChI=1S/C26H33N7O/c1-17(2)19-7-6-8-20(13-19)32-15-22(28-16-32)26(10-11-26)30-24-27-12-9-23(29-24)33-21(18(3)4)14-31(5)25(33)34/h6-9,12-13,15-18,21H,10-11,14H2,1-5H3,(H,27,29,30)/t21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445320
PNG
(US10682352, Compound 42 | methyl (S)-methyl-3-(4-(...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(Br)c2)n1
Show InChI InChI=1S/C23H26BrN7O/c1-15(2)18-12-29(3)22(32)31(18)20-7-10-25-21(27-20)28-23(8-9-23)19-13-30(14-26-19)17-6-4-5-16(24)11-17/h4-7,10-11,13-15,18H,8-9,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445321
PNG
((S)-3-(2-((1-(1-(benzo[d][1,3]dioxol-5-yl)-1H-imid...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc3OCOc3c2)n1
Show InChI InChI=1S/C24H27N7O3/c1-15(2)17-11-29(3)23(32)31(17)21-6-9-25-22(27-21)28-24(7-8-24)20-12-30(13-26-20)16-4-5-18-19(10-16)34-14-33-18/h4-6,9-10,12-13,15,17H,7-8,11,14H2,1-3H3,(H,25,27,28)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445349
PNG
((S)-3-(2-(((S)-1-(1-(4-cyclopropylphenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C2CC2)n1
Show InChI InChI=1S/C25H31N7O/c1-16(2)22-14-30(4)25(33)32(22)23-11-12-26-24(29-23)28-17(3)21-13-31(15-27-21)20-9-7-19(8-10-20)18-5-6-18/h7-13,15-18,22H,5-6,14H2,1-4H3,(H,26,28,29)/t17-,22+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445364
PNG
((S)-3-(6-chloro-2-(((S)-1-(1-(4-fluorophenyl)-1H-i...)
Show SMILES C[C@H](Nc1nc(Cl)cc(n1)N1[C@H](CN(C)C1=O)C1CC1)c1cn(cn1)-c1ccc(F)cc1
Show InChI InChI=1S/C22H23ClFN7O/c1-13(17-10-30(12-25-17)16-7-5-15(24)6-8-16)26-21-27-19(23)9-20(28-21)31-18(14-3-4-14)11-29(2)22(31)32/h5-10,12-14,18H,3-4,11H2,1-2H3,(H,26,27,28)/t13-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445373
PNG
(US10682352, Compound 86)
Show SMILES CC(C)[C@H]1[C@H](C)NC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-13(2)20-15(4)27-22(31)30(20)19-9-10-24-21(28-19)26-14(3)18-11-29(12-25-18)17-7-5-16(23)6-8-17/h5-15,20H,1-4H3,(H,27,31)(H,24,26,28)/t14-,15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445391
PNG
(US10682352, Compound 104)
Show SMILES CC(C)[C@@H]1N(C(=O)NC11COC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H26ClN7O2/c1-14(2)20-23(11-33-12-23)29-22(32)31(20)19-8-9-25-21(28-19)27-15(3)18-10-30(13-26-18)17-6-4-16(24)5-7-17/h4-10,13-15,20H,11-12H2,1-3H3,(H,29,32)(H,25,27,28)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445299
PNG
((S)-3-(2-((1-(1-(3,5-dichlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)cc(Cl)c2)n1
Show InChI InChI=1S/C23H25Cl2N7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445275
PNG
((S)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES C[C@H](Nc1nccc(n1)N1[C@H](CNC1=O)c1ccccc1)c1cn(cn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C24H22ClN7O/c1-16(20-14-31(15-28-20)19-9-7-18(25)8-10-19)29-23-26-12-11-22(30-23)32-21(13-27-24(32)33)17-5-3-2-4-6-17/h2-12,14-16,21H,13H2,1H3,(H,27,33)(H,26,29,30)/t16-,21+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445293
PNG
((S)-5-isopropyl-1-(2-((1-(1-(3-(trifluoromethyl)ph...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H24F3N7O/c1-14(2)17-11-28-21(34)33(17)19-6-9-27-20(30-19)31-22(7-8-22)18-12-32(13-29-18)16-5-3-4-15(10-16)23(24,25)26/h3-6,9-10,12-14,17H,7-8,11H2,1-2H3,(H,28,34)(H,27,30,31)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445295
PNG
((S)-3-(2-((1-(1-(3-chloro-4-methylphenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(C)c(Cl)c2)n1
Show InChI InChI=1S/C24H28ClN7O/c1-15(2)19-12-30(4)23(33)32(19)21-7-10-26-22(28-21)29-24(8-9-24)20-13-31(14-27-20)17-6-5-16(3)18(25)11-17/h5-7,10-11,13-15,19H,8-9,12H2,1-4H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445311
PNG
((S)-4-isopropyl-1-methyl-3-(2-((1-(1-(4-methylcycl...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)C2CCC(C)CC2)n1
Show InChI InChI=1S/C24H35N7O/c1-16(2)19-13-29(4)23(32)31(19)21-9-12-25-22(27-21)28-24(10-11-24)20-14-30(15-26-20)18-7-5-17(3)6-8-18/h9,12,14-19H,5-8,10-11,13H2,1-4H3,(H,25,27,28)/t17?,18?,19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445322
PNG
((S)-3-(2-((1-(1-(3-bromo-5-chlorophenyl)-1H-imidaz...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)cc(Br)c2)n1
Show InChI InChI=1S/C23H25BrClN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445334
PNG
((S)-3-(2-((1-(1-(5-chloro-2-fluorophenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)ccc2F)n1
Show InChI InChI=1S/C23H25ClFN7O/c1-14(2)18-11-30(3)22(33)32(18)20-6-9-26-21(28-20)29-23(7-8-23)19-12-31(13-27-19)17-10-15(24)4-5-16(17)25/h4-6,9-10,12-14,18H,7-8,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445345
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-14(2)19-12-31(4)22(34)33(19)20-9-10-27-21(30-20)29-15(3)18-11-32(13-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-11,13-15,19H,12H2,1-4H3,(H,27,29,30)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445355
PNG
(US10682352, Compound 68 | Using the same manner as...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(C)C)n1
Show InChI InChI=1S/C25H33N7O/c1-16(2)19-7-9-20(10-8-19)31-13-21(27-15-31)18(5)28-24-26-12-11-23(29-24)32-22(17(3)4)14-30(6)25(32)33/h7-13,15-18,22H,14H2,1-6H3,(H,26,28,29)/t18-,22+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445367
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1nc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)ncc1F
Show InChI InChI=1S/C22H25ClFN7O/c1-13(2)19-11-29(4)22(32)31(19)20-17(24)9-25-21(28-20)27-14(3)18-10-30(12-26-18)16-7-5-15(23)6-8-16/h5-10,12-14,19H,11H2,1-4H3,(H,25,27,28)/t14-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445288
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-9-10-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-16(23)6-8-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445374
PNG
((5S)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1[C@@H](C)NC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-13(2)20-15(4)27-22(31)30(20)19-9-10-24-21(28-19)26-14(3)18-11-29(12-25-18)17-7-5-16(23)6-8-17/h5-15,20H,1-4H3,(H,27,31)(H,24,26,28)/t14-,15+,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445370
PNG
((S)-1-(2-(((S)-1-(1-(4-(trifluoromethyl)phenyl)-1H...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C22H24F3N7O/c1-13(2)18-10-27-21(33)32(18)19-8-9-26-20(30-19)29-14(3)17-11-31(12-28-17)16-6-4-15(5-7-16)22(23,24)25/h4-9,11-14,18H,10H2,1-3H3,(H,27,33)(H,26,29,30)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445345
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-14(2)19-12-31(4)22(34)33(19)20-9-10-27-21(30-20)29-15(3)18-11-32(13-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-11,13-15,19H,12H2,1-4H3,(H,27,29,30)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445384
PNG
((S)-3-(2-((1-(1-(3-chloro-5-fluorophenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(F)cc(Cl)c2)n1
Show InChI InChI=1S/C23H25ClFN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445389
PNG
((S)-7-isopropyl-6-(2-(((S)-1-(1-(4-(trifluoromethy...)
Show SMILES CC(C)[C@@H]1N(C(=O)NC11CC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C24H26F3N7O/c1-14(2)20-23(9-10-23)32-22(35)34(20)19-8-11-28-21(31-19)30-15(3)18-12-33(13-29-18)17-6-4-16(5-7-17)24(25,26)27/h4-8,11-15,20H,9-10H2,1-3H3,(H,32,35)(H,28,30,31)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445268
PNG
((R)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C21H24ClN7O/c1-13(2)18-10-24-21(30)29(18)19-8-9-23-20(27-19)26-14(3)17-11-28(12-25-17)16-6-4-15(22)5-7-16/h4-9,11-14,18H,10H2,1-3H3,(H,24,30)(H,23,26,27)/t14-,18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445289
PNG
((S)-3-(2-(((R)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-9-10-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-16(23)6-8-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445292
PNG
((S)-1-(2-((1-(1-(4-ethylphenyl)-1H-imidazol-4-yl)c...)
Show SMILES CCc1ccc(cc1)-n1cnc(c1)C1(CC1)Nc1nccc(n1)N1[C@H](CNC1=O)C(C)C
Show InChI InChI=1S/C24H29N7O/c1-4-17-5-7-18(8-6-17)30-14-20(27-15-30)24(10-11-24)29-22-25-12-9-21(28-22)31-19(16(2)3)13-26-23(31)32/h5-9,12,14-16,19H,4,10-11,13H2,1-3H3,(H,26,32)(H,25,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445295
PNG
((S)-3-(2-((1-(1-(3-chloro-4-methylphenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(C)c(Cl)c2)n1
Show InChI InChI=1S/C24H28ClN7O/c1-15(2)19-12-30(4)23(33)32(19)21-7-10-26-22(28-21)29-24(8-9-24)20-13-31(14-27-20)17-6-5-16(3)18(25)11-17/h5-7,10-11,13-15,19H,8-9,12H2,1-4H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445332
PNG
((S)-1-(2-(((S)-1-(1-(3-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cccc(Cl)c2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-8-9-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-6-16(23)10-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445337
PNG
((S)-3-(2-((S)-1-(1-(3-cyclopropphenyl)-1-hydro-imi...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cccc(c2)C2CC2)n1
Show InChI InChI=1S/C25H31N7O/c1-16(2)22-14-30(4)25(33)32(22)23-10-11-26-24(29-23)28-17(3)21-13-31(15-27-21)20-7-5-6-19(12-20)18-8-9-18/h5-7,10-13,15-18,22H,8-9,14H2,1-4H3,(H,26,28,29)/t17-,22+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445327
PNG
((S)-3-(2-((1-(1-(3-bromo-5-fluorophenyl)-imidazol-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(F)cc(Br)c2)n1
Show InChI InChI=1S/C23H25BrFN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445363
PNG
(US10682352, Compound 76 | Using the same manner as...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(c(C)n2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-14(2)20-13-29(5)23(32)31(20)21-10-11-25-22(28-21)26-15(3)19-12-30(16(4)27-19)18-8-6-17(24)7-9-18/h6-12,14-15,20H,13H2,1-5H3,(H,25,26,28)/t15-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445377
PNG
(US10682352, Compound 90)
Show SMILES CC(C)[C@H]1[C@@H](C)N(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-14(2)21-16(4)29(5)23(32)31(21)20-10-11-25-22(28-20)27-15(3)19-12-30(13-26-19)18-8-6-17(24)7-9-18/h6-16,21H,1-5H3,(H,25,27,28)/t15-,16+,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445382
PNG
((4S)-4-isopropyl-1,5-methyl-3-(2-(((S)-1-(1-(4-tri...)
Show SMILES CC(C)[C@H]1[C@H](C)N(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C24H28F3N7O/c1-14(2)21-16(4)32(5)23(35)34(21)20-10-11-28-22(31-20)30-15(3)19-12-33(13-29-19)18-8-6-17(7-9-18)24(25,26)27/h6-16,21H,1-5H3,(H,28,30,31)/t15-,16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445401
PNG
((S)-1-(2-(((S)-1-(2′-(trifluoromethyl)-[3,4&...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2ccc(cn2)-c2ccnc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H24F3N7O/c1-13(2)18-12-30-22(34)33(18)20-7-9-28-21(32-20)31-14(3)17-5-4-16(11-29-17)15-6-8-27-19(10-15)23(24,25)26/h4-11,13-14,18H,12H2,1-3H3,(H,30,34)(H,28,31,32)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445300
PNG
((S)-4-isopropyl-1-methyl-3-(2-((1-(1-(3-(trifluoro...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H26F3N7O/c1-15(2)18-12-32(3)22(35)34(18)20-7-10-28-21(30-20)31-23(8-9-23)19-13-33(14-29-19)17-6-4-5-16(11-17)24(25,26)27/h4-7,10-11,13-15,18H,8-9,12H2,1-3H3,(H,28,30,31)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445301
PNG
((S)-3-(2-((1-(1-(3-chloro-4-fluorophenyl)-1H-imida...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(F)c(Cl)c2)n1
Show InChI InChI=1S/C23H25ClFN7O/c1-14(2)18-11-30(3)22(33)32(18)20-6-9-26-21(28-20)29-23(7-8-23)19-12-31(13-27-19)15-4-5-17(25)16(24)10-15/h4-6,9-10,12-14,18H,7-8,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445308
PNG
((S)-3-(2-((1-(1-(3-cyclopropylphenyl)amino)pyrimid...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(c2)C2CC2)n1
Show InChI InChI=1S/C26H31N7O/c1-17(2)21-14-31(3)25(34)33(21)23-9-12-27-24(29-23)30-26(10-11-26)22-15-32(16-28-22)20-6-4-5-19(13-20)18-7-8-18/h4-6,9,12-13,15-18,21H,7-8,10-11,14H2,1-3H3,(H,27,29,30)/t21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445348
PNG
(US10682352, Compound 61 | Using the same manner as...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)c(Cl)c2)n1
Show InChI InChI=1S/C22H25Cl2N7O/c1-13(2)19-11-29(4)22(32)31(19)20-7-8-25-21(28-20)27-14(3)18-10-30(12-26-18)15-5-6-16(23)17(24)9-15/h5-10,12-14,19H,11H2,1-4H3,(H,25,27,28)/t14-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445350
PNG
((S)-1-(2-(((S)-1-(1-(3-fluoro-4-chlorophenyl)-1H-i...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)c(F)c2)n1
Show InChI InChI=1S/C22H25ClFN7O/c1-13(2)19-11-29(4)22(32)31(19)20-7-8-25-21(28-20)27-14(3)18-10-30(12-26-18)15-5-6-16(23)17(24)9-15/h5-10,12-14,19H,11H2,1-4H3,(H,25,27,28)/t14-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445288
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-9-10-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-16(23)6-8-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445269
PNG
((S)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C21H24ClN7O/c1-13(2)18-10-24-21(30)29(18)19-8-9-23-20(27-19)26-14(3)17-11-28(12-25-17)16-6-4-15(22)5-7-16/h4-9,11-14,18H,10H2,1-3H3,(H,24,30)(H,23,26,27)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445379
PNG
(US10682352, Compound 92)
Show SMILES CC(C)[C@H]1[C@@H](C)NC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-13(2)20-15(4)30-22(34)33(20)19-9-10-27-21(31-19)29-14(3)18-11-32(12-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-15,20H,1-4H3,(H,30,34)(H,27,29,31)/t14-,15+,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445388
PNG
((S)-5-isopropyl-4,4-dimethyl-1-(2-(((S)-1-(1-(4-(t...)
Show SMILES CC(C)[C@@H]1N(C(=O)NC1(C)C)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C24H28F3N7O/c1-14(2)20-23(4,5)32-22(35)34(20)19-10-11-28-21(31-19)30-15(3)18-12-33(13-29-18)17-8-6-16(7-9-17)24(25,26)27/h6-15,20H,1-5H3,(H,32,35)(H,28,30,31)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445393
PNG
((S)-8-isopropyl-5-methyl-7-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@@H]1N(C(=O)N(C)C11COC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C25H28F3N7O2/c1-15(2)21-24(12-37-13-24)33(4)23(36)35(21)20-9-10-29-22(32-20)31-16(3)19-11-34(14-30-19)18-7-5-17(6-8-18)25(26,27)28/h5-11,14-16,21H,12-13H2,1-4H3,(H,29,31,32)/t16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445291
PNG
((S)-5-isopropyl-1-(2-((1-(1-(p-tolyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(C)cc2)n1
Show InChI InChI=1S/C23H27N7O/c1-15(2)18-12-25-22(31)30(18)20-8-11-24-21(27-20)28-23(9-10-23)19-13-29(14-26-19)17-6-4-16(3)5-7-17/h4-8,11,13-15,18H,9-10,12H2,1-3H3,(H,25,31)(H,24,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445305
PNG
((S)-3-(2-((1-(1-(3-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(Cl)c2)n1
Show InChI InChI=1S/C23H26ClN7O/c1-15(2)18-12-29(3)22(32)31(18)20-7-10-25-21(27-20)28-23(8-9-23)19-13-30(14-26-19)17-6-4-5-16(24)11-17/h4-7,10-11,13-15,18H,8-9,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445342
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(1-(p-tolyl)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(C)cc2)n1
Show InChI InChI=1S/C23H29N7O/c1-15(2)20-13-28(5)23(31)30(20)21-10-11-24-22(27-21)26-17(4)19-12-29(14-25-19)18-8-6-16(3)7-9-18/h6-12,14-15,17,20H,13H2,1-5H3,(H,24,26,27)/t17-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445352
PNG
((S)-3-(2-(((S)-1-(1-(4-chloro-3-methoxyphenyl)-1H-...)
Show SMILES COc1cc(ccc1Cl)-n1cnc(c1)[C@H](C)Nc1nccc(n1)N1[C@H](CN(C)C1=O)C(C)C
Show InChI InChI=1S/C23H28ClN7O2/c1-14(2)19-12-29(4)23(32)31(19)21-8-9-25-22(28-21)27-15(3)18-11-30(13-26-18)16-6-7-17(24)20(10-16)33-5/h6-11,13-15,19H,12H2,1-5H3,(H,25,27,28)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445370
PNG
((S)-1-(2-(((S)-1-(1-(4-(trifluoromethyl)phenyl)-1H...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C22H24F3N7O/c1-13(2)18-10-27-21(33)32(18)19-8-9-26-20(30-19)29-14(3)17-11-31(12-28-17)16-6-4-15(5-7-16)22(23,24)25/h4-9,11-14,18H,10H2,1-3H3,(H,27,33)(H,26,29,30)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445378
PNG
((5S)-1-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1[C@H](C)N(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-14(2)21-16(4)29(5)23(32)31(21)20-10-11-25-22(28-20)27-15(3)19-12-30(13-26-19)18-8-6-17(24)7-9-18/h6-16,21H,1-5H3,(H,25,27,28)/t15-,16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM363689
PNG
(US10640534, Compound 176 | US10682352, Compound AG...)
Show SMILES Fc1cncc(c1)N([C@H](C(=O)NC1CC(F)(F)C1)c1ccccc1Cl)C(=O)[C@@H]1CCC(=O)N1c1cc(ccn1)C#N
Show InChI InChI=1S/C28H22ClF3N6O3/c29-21-4-2-1-3-20(21)25(26(40)36-18-11-28(31,32)12-18)37(19-10-17(30)14-34-15-19)27(41)22-5-6-24(39)38(22)23-9-16(13-33)7-8-35-23/h1-4,7-10,14-15,18,22,25H,5-6,11-12H2,(H,36,40)/t22-,25-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445299
PNG
((S)-3-(2-((1-(1-(3,5-dichlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)cc(Cl)c2)n1
Show InChI InChI=1S/C23H25Cl2N7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445322
PNG
((S)-3-(2-((1-(1-(3-bromo-5-chlorophenyl)-1H-imidaz...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)cc(Br)c2)n1
Show InChI InChI=1S/C23H25BrClN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445326
PNG
((S)-3-(2-((1-(1-(4,4-dimethylcyclohexyl)-1H-imidaz...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)C2CCC(C)(C)CC2)n1
Show InChI InChI=1S/C25H37N7O/c1-17(2)19-14-30(5)23(33)32(19)21-8-13-26-22(28-21)29-25(11-12-25)20-15-31(16-27-20)18-6-9-24(3,4)10-7-18/h8,13,15-19H,6-7,9-12,14H2,1-5H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445385
PNG
(US10682352, Compound 98)
Show SMILES CC(C)[C@@H]1N(C(=O)NC1(C)C)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-14(2)20-23(4,5)29-22(32)31(20)19-10-11-25-21(28-19)27-15(3)18-12-30(13-26-18)17-8-6-16(24)7-9-17/h6-15,20H,1-5H3,(H,29,32)(H,25,27,28)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445387
PNG
((S)-6-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@@H]1N(C(=O)N(C)C11CC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C24H28ClN7O/c1-15(2)21-24(10-11-24)30(4)23(33)32(21)20-9-12-26-22(29-20)28-16(3)19-13-31(14-27-19)18-7-5-17(25)6-8-18/h5-9,12-16,21H,10-11H2,1-4H3,(H,26,28,29)/t16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445307
PNG
((S)-3-(2-((1-(1-(cyclohexylmethyl)-1H-imidazol-4-y...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(CC3CCCCC3)cn2)n1
Show InChI InChI=1S/C24H35N7O/c1-17(2)19-14-29(3)23(32)31(19)21-9-12-25-22(27-21)28-24(10-11-24)20-15-30(16-26-20)13-18-7-5-4-6-8-18/h9,12,15-19H,4-8,10-11,13-14H2,1-3H3,(H,25,27,28)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445312
PNG
((S)-3-(2-((1-(1-(3-chloro-5-methoxyphenyl)-1H-imid...)
Show SMILES COc1cc(Cl)cc(c1)-n1cnc(c1)C1(CC1)Nc1nccc(n1)N1[C@H](CN(C)C1=O)C(C)C
Show InChI InChI=1S/C24H28ClN7O2/c1-15(2)19-12-30(3)23(33)32(19)21-5-8-26-22(28-21)29-24(6-7-24)20-13-31(14-27-20)17-9-16(25)10-18(11-17)34-4/h5,8-11,13-15,19H,6-7,12H2,1-4H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445288
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H26ClN7O/c1-14(2)19-12-28(4)22(31)30(19)20-9-10-24-21(27-20)26-15(3)18-11-29(13-25-18)17-7-5-16(23)6-8-17/h5-11,13-15,19H,12H2,1-4H3,(H,24,26,27)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445305
PNG
((S)-3-(2-((1-(1-(3-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(Cl)c2)n1
Show InChI InChI=1S/C23H26ClN7O/c1-15(2)18-12-29(3)22(32)31(18)20-7-10-25-21(27-20)28-23(8-9-23)19-13-30(14-26-19)17-6-4-5-16(24)11-17/h4-7,10-11,13-15,18H,8-9,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445345
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(1-(4-triflu...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-14(2)19-12-31(4)22(34)33(19)20-9-10-27-21(30-20)29-15(3)18-11-32(13-28-18)17-7-5-16(6-8-17)23(24,25)26/h5-11,13-15,19H,12H2,1-4H3,(H,27,29,30)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445302
PNG
((S)-5-isopropyl-1-(2-((1-(1-(6-methylpyridin-3-yl)...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(C)nc2)n1
Show InChI InChI=1S/C22H26N8O/c1-14(2)17-11-25-21(31)30(17)19-6-9-23-20(27-19)28-22(7-8-22)18-12-29(13-26-18)16-5-4-15(3)24-10-16/h4-6,9-10,12-14,17H,7-8,11H2,1-3H3,(H,25,31)(H,23,27,28)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445322
PNG
((S)-3-(2-((1-(1-(3-bromo-5-chlorophenyl)-1H-imidaz...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2cc(Cl)cc(Br)c2)n1
Show InChI InChI=1S/C23H25BrClN7O/c1-14(2)18-11-30(3)22(33)32(18)20-4-7-26-21(28-20)29-23(5-6-23)19-12-31(13-27-19)17-9-15(24)8-16(25)10-17/h4,7-10,12-14,18H,5-6,11H2,1-3H3,(H,26,28,29)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445347
PNG
((S)-3-(2-(((S)-1-(1-(3,5-dichlorophenyl)-1hydro-im...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cc(Cl)cc(Cl)c2)n1
Show InChI InChI=1S/C22H25Cl2N7O/c1-13(2)19-11-29(4)22(32)31(19)20-5-6-25-21(28-20)27-14(3)18-10-30(12-26-18)17-8-15(23)7-16(24)9-17/h5-10,12-14,19H,11H2,1-4H3,(H,25,27,28)/t14-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445368
PNG
(US10682352, Compound 81)
Show SMILES C[C@@H](O)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C21H24ClN7O2/c1-13(17-10-28(12-24-17)16-6-4-15(22)5-7-16)25-20-23-9-8-19(26-20)29-18(14(2)30)11-27(3)21(29)31/h4-10,12-14,18,30H,11H2,1-3H3,(H,23,25,26)/t13-,14+,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445401
PNG
((S)-1-(2-(((S)-1-(2′-(trifluoromethyl)-[3,4&...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2ccc(cn2)-c2ccnc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H24F3N7O/c1-13(2)18-12-30-22(34)33(18)20-7-9-28-21(32-20)31-14(3)17-5-4-16(11-29-17)15-6-8-27-19(10-15)23(24,25)26/h4-11,13-14,18H,12H2,1-3H3,(H,30,34)(H,28,31,32)/t14-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445281
PNG
((S)-1-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES C[C@H](Nc1nccc(n1)N1C(=O)NCC11CCCC1)c1cn(cn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C22H24ClN7O/c1-15(18-12-29(14-26-18)17-6-4-16(23)5-7-17)27-20-24-11-8-19(28-20)30-21(31)25-13-22(30)9-2-3-10-22/h4-8,11-12,14-15H,2-3,9-10,13H2,1H3,(H,25,31)(H,24,27,28)/t15-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445285
PNG
((S)-1-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES Clc1ccc(cc1)-n1cnc(c1)C1(CC1)Nc1nccc(n1)N1[C@H](CNC1=O)C1CC1
Show InChI InChI=1S/C22H22ClN7O/c23-15-3-5-16(6-4-15)29-12-18(26-13-29)22(8-9-22)28-20-24-10-7-19(27-20)30-17(14-1-2-14)11-25-21(30)31/h3-7,10,12-14,17H,1-2,8-9,11H2,(H,25,31)(H,24,27,28)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445290
PNG
((S)-3-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H26ClN7O/c1-15(2)18-12-29(3)22(32)31(18)20-8-11-25-21(27-20)28-23(9-10-23)19-13-30(14-26-19)17-6-4-16(24)5-7-17/h4-8,11,13-15,18H,9-10,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445310
PNG
((S)-3-(2-((1-(1-(4,4-difluorocyclohexyl)-1H-imidaz...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)C2CCC(F)(F)CC2)n1
Show InChI InChI=1S/C23H31F2N7O/c1-15(2)17-12-30(3)21(33)32(17)19-6-11-26-20(28-19)29-22(9-10-22)18-13-31(14-27-18)16-4-7-23(24,25)8-5-16/h6,11,13-17H,4-5,7-10,12H2,1-3H3,(H,26,28,29)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445313
PNG
((S)-3-(2-((1-(1-(4-cyclopropylphenyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(cc2)C2CC2)n1
Show InChI InChI=1S/C26H31N7O/c1-17(2)21-14-31(3)25(34)33(21)23-10-13-27-24(29-23)30-26(11-12-26)22-15-32(16-28-22)20-8-6-19(7-9-20)18-4-5-18/h6-10,13,15-18,21H,4-5,11-12,14H2,1-3H3,(H,27,29,30)/t21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445341
PNG
(US10682352, Compound 54 | Using the same manner as...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cccc(c2)C(C)C)n1
Show InChI InChI=1S/C25H33N7O/c1-16(2)19-8-7-9-20(12-19)31-13-21(27-15-31)18(5)28-24-26-11-10-23(29-24)32-22(17(3)4)14-30(6)25(32)33/h7-13,15-18,22H,14H2,1-6H3,(H,26,28,29)/t18-,22+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445366
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES C[C@H](Nc1nc(C)cc(n1)N1[C@H](CN(C)C1=O)C1CC1)c1cn(cn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C23H26ClN7O/c1-14-10-21(31-20(16-4-5-16)12-29(3)23(31)32)28-22(26-14)27-15(2)19-11-30(13-25-19)18-8-6-17(24)7-9-18/h6-11,13,15-16,20H,4-5,12H2,1-3H3,(H,26,27,28)/t15-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445396
PNG
(((S)-4-isopropyl-5,5-dideutero-1-methyl-3-(2-(((S)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cc(C)c(cn2)-c2ccnc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C25H28F3N7O/c1-14(2)20-13-34(5)24(36)35(20)22-7-9-30-23(33-22)32-16(4)19-10-15(3)18(12-31-19)17-6-8-29-21(11-17)25(26,27)28/h6-12,14,16,20H,13H2,1-5H3,(H,30,32,33)/t16-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445282
PNG
((S)-1-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES C[C@H](Nc1nccc(n1)N1C(=O)NCC1(C)C)c1cn(cn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C20H22ClN7O/c1-13(16-10-27(12-24-16)15-6-4-14(21)5-7-15)25-18-22-9-8-17(26-18)28-19(29)23-11-20(28,2)3/h4-10,12-13H,11H2,1-3H3,(H,23,29)(H,22,25,26)/t13-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445266
PNG
(2-chloro-N-cyclopentyl-4-(1-((4-((S)-5-isopropyl-2...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC(C)c2ccc(C(=O)NC3CCCC3)c(Cl)c2)n1
Show InChI InChI=1S/C24H31ClN6O2/c1-14(2)20-13-27-24(33)31(20)21-10-11-26-23(30-21)28-15(3)16-8-9-18(19(25)12-16)22(32)29-17-6-4-5-7-17/h8-12,14-15,17,20H,4-7,13H2,1-3H3,(H,27,33)(H,29,32)(H,26,28,30)/t15?,20-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445273
PNG
((S)-1-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C22H24ClN7O/c1-14(2)17-11-25-21(31)30(17)19-7-10-24-20(27-19)28-22(8-9-22)18-12-29(13-26-18)16-5-3-15(23)4-6-16/h3-7,10,12-14,17H,8-9,11H2,1-2H3,(H,25,31)(H,24,27,28)/t17-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445296
PNG
((S)-5-isopropyl-1-(2-(1-(1-(5-methylpyridin-2-yl)-...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccc(C)cn2)n1
Show InChI InChI=1S/C22H26N8O/c1-14(2)16-11-25-21(31)30(16)19-6-9-23-20(27-19)28-22(7-8-22)17-12-29(13-26-17)18-5-4-15(3)10-24-18/h4-6,9-10,12-14,16H,7-8,11H2,1-3H3,(H,25,31)(H,23,27,28)/t16-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445319
PNG
(US10682352, Compound 41)
Show SMILES CCN1C[C@H](C(C)C)N(C1=O)c1ccnc(NC2(CC2)c2cn(cn2)-c2cccc(Cl)c2)n1
Show InChI InChI=1S/C24H28ClN7O/c1-4-30-13-19(16(2)3)32(23(30)33)21-8-11-26-22(28-21)29-24(9-10-24)20-14-31(15-27-20)18-7-5-6-17(25)12-18/h5-8,11-12,14-16,19H,4,9-10,13H2,1-3H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445356
PNG
((S)-1-(3-cyclopropylphenyl)-4-(1-((4-(5-isopropyl-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2ncn(c2Br)-c2cccc(c2)C2CC2)n1
Show InChI InChI=1S/C26H30BrN7O/c1-16(2)20-14-32(3)25(35)34(20)21-9-12-28-24(30-21)31-26(10-11-26)22-23(27)33(15-29-22)19-6-4-5-18(13-19)17-7-8-17/h4-6,9,12-13,15-17,20H,7-8,10-11,14H2,1-3H3,(H,28,30,31)/t20-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445358
PNG
((S)-3-(2-((1-(1-(3-cyclopropylphenyl)-1H-imidazol-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CCC2)c2cn(cn2)-c2cccc(Br)c2)n1
Show InChI InChI=1S/C24H28BrN7O/c1-16(2)19-13-30(3)23(33)32(19)21-8-11-26-22(28-21)29-24(9-5-10-24)20-14-31(15-27-20)18-7-4-6-17(25)12-18/h4,6-8,11-12,14-16,19H,5,9-10,13H2,1-3H3,(H,26,28,29)/t19-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445362
PNG
((S)-3-(2-(((S)-1-(1-(4,4-difluorocyclohexyl)-1H-im...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)C2CCC(F)(F)CC2)n1
Show InChI InChI=1S/C22H31F2N7O/c1-14(2)18-12-29(4)21(32)31(18)19-7-10-25-20(28-19)27-15(3)17-11-30(13-26-17)16-5-8-22(23,24)9-6-16/h7,10-11,13-16,18H,5-6,8-9,12H2,1-4H3,(H,25,27,28)/t15-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445390
PNG
((S)-7-isopropyl-4-methyl-6-(2-(((S)-1-(1-(4-(trifl...)
Show SMILES CC(C)[C@@H]1N(C(=O)N(C)C11CC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(cc2)C(F)(F)F)n1
Show InChI InChI=1S/C25H28F3N7O/c1-15(2)21-24(10-11-24)33(4)23(36)35(21)20-9-12-29-22(32-20)31-16(3)19-13-34(14-30-19)18-7-5-17(6-8-18)25(26,27)28/h5-9,12-16,21H,10-11H2,1-4H3,(H,29,31,32)/t16-,21-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445395
PNG
(Compound (S)-4,4,-dideutero-5-isopropyl-1-(2-(((S)...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(N[C@@H](C)c2cc(C)c(cn2)-c2ccnc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C24H26F3N7O/c1-13(2)19-12-31-23(35)34(19)21-6-8-29-22(33-21)32-15(4)18-9-14(3)17(11-30-18)16-5-7-28-20(10-16)24(25,26)27/h5-11,13,15,19H,12H2,1-4H3,(H,31,35)(H,29,32,33)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445272
PNG
((5S)-1-(2-((1-([1,1′-biphenyl]-4-yl)ethyl)am...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC(C)c2ccc(cc2)-c2ccccc2)n1
Show InChI InChI=1S/C24H27N5O/c1-16(2)21-15-26-24(30)29(21)22-13-14-25-23(28-22)27-17(3)18-9-11-20(12-10-18)19-7-5-4-6-8-19/h4-14,16-17,21H,15H2,1-3H3,(H,26,30)(H,25,27,28)/t17?,21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445351
PNG
((S)-3-(2-((1-(1-(3-cyclopropylphenyl)-1H-[1,2,4]-t...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2ncn(n2)-c2cccc(c2)C2CC2)n1
Show InChI InChI=1S/C25H30N8O/c1-16(2)20-14-31(3)24(34)33(20)21-9-12-26-23(28-21)29-25(10-11-25)22-27-15-32(30-22)19-6-4-5-18(13-19)17-7-8-17/h4-6,9,12-13,15-17,20H,7-8,10-11,14H2,1-3H3,(H,26,28,29)/t20-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445267
PNG
((S)-3-(2-(((S)-1-(5-(3-chlorophenyl)pyridin-2-yl)e...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2ccc(cn2)-c2cccc(Cl)c2)n1
Show InChI InChI=1S/C24H27ClN6O/c1-15(2)21-14-30(4)24(32)31(21)22-10-11-26-23(29-22)28-16(3)20-9-8-18(13-27-20)17-6-5-7-19(25)12-17/h5-13,15-16,21H,14H2,1-4H3,(H,26,28,29)/t16-,21+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445287
PNG
((S)-1-(2-((1-(4′-chloro-[1,1′-biphenyl...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC2(CC2)c2ccc(cc2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C25H26ClN5O/c1-16(2)21-15-28-24(32)31(21)22-11-14-27-23(29-22)30-25(12-13-25)19-7-3-17(4-8-19)18-5-9-20(26)10-6-18/h3-11,14,16,21H,12-13,15H2,1-2H3,(H,28,32)(H,27,29,30)/t21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445353
PNG
((S)-3-(2-(((S)-1-(1-isopentyl-1H-imidazol-4-yl)yl)...)
Show SMILES CC(C)CCn1cnc(c1)[C@H](C)Nc1nccc(n1)N1[C@H](CN(C)C1=O)C(C)C
Show InChI InChI=1S/C21H33N7O/c1-14(2)8-10-27-11-17(23-13-27)16(5)24-20-22-9-7-19(25-20)28-18(15(3)4)12-26(6)21(28)29/h7,9,11,13-16,18H,8,10,12H2,1-6H3,(H,22,24,25)/t16-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445361
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl) 1H-imidazol-4...)
Show SMILES CCN1C[C@H](C(C)C)N(C1=O)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-5-29-13-20(15(2)3)31(23(29)32)21-10-11-25-22(28-21)27-16(4)19-12-30(14-26-19)18-8-6-17(24)7-9-18/h6-12,14-16,20H,5,13H2,1-4H3,(H,25,27,28)/t16-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445271
PNG
((S)-5-isopropyl-1-(2-(((S)-1-(6-methoxynaphthalen-...)
Show SMILES COc1ccc2cc(ccc2c1)[C@H](C)Nc1nccc(n1)N1[C@H](CNC1=O)C(C)C
Show InChI InChI=1S/C23H27N5O2/c1-14(2)20-13-25-23(29)28(20)21-9-10-24-22(27-21)26-15(3)16-5-6-18-12-19(30-4)8-7-17(18)11-16/h5-12,14-15,20H,13H2,1-4H3,(H,25,29)(H,24,26,27)/t15-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445283
PNG
((S)-1-(2-((1-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES Clc1ccc(cc1)-n1cnc(c1)C1(CC1)Nc1nccc(n1)N1[C@H](CNC1=O)c1ccccc1
Show InChI InChI=1S/C25H22ClN7O/c26-18-6-8-19(9-7-18)32-15-21(29-16-32)25(11-12-25)31-23-27-13-10-22(30-23)33-20(14-28-24(33)34)17-4-2-1-3-5-17/h1-10,13,15-16,20H,11-12,14H2,(H,28,34)(H,27,30,31)/t20-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445270
PNG
((S)-4-isopropyl-1-methyl-3-(2-(((S)-1-(5-(3-(trifl...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(cn2)-c2ccccc2Cl)n1
Show InChI InChI=1S/C23H26ClN7O/c1-15(2)18-12-29(3)22(32)31(18)20-8-11-25-21(27-20)28-23(9-10-23)19-13-30(14-26-19)17-7-5-4-6-16(17)24/h4-8,11,13-15,18H,9-10,12H2,1-3H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445346
PNG
((S)-4-isopropyl-1-methyl-3-(2-((S)-1-(1-(3-trifluo...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2cccc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C23H26F3N7O/c1-14(2)19-12-31(4)22(34)33(19)20-8-9-27-21(30-20)29-15(3)18-11-32(13-28-18)17-7-5-6-16(10-17)23(24,25)26/h5-11,13-15,19H,12H2,1-4H3,(H,27,29,30)/t15-,19+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445357
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-1,2,4-tria...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2ncn(n2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C21H25ClN8O/c1-13(2)17-11-28(4)21(31)30(17)18-9-10-23-20(26-18)25-14(3)19-24-12-29(27-19)16-7-5-15(22)6-8-16/h5-10,12-14,17H,11H2,1-4H3,(H,23,25,26)/t14-,17+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445359
PNG
((S)-3-(2-((2-(1-(4-chlorophenyl)-1H-imidazol-4-yl)...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC(C)(C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H28ClN7O/c1-15(2)18-12-29(5)22(32)31(18)20-10-11-25-21(27-20)28-23(3,4)19-13-30(14-26-19)17-8-6-16(24)7-9-17/h6-11,13-15,18H,12H2,1-5H3,(H,25,27,28)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445360
PNG
((S)-3-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@H]1CN(C2CC2)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C24H28ClN7O/c1-15(2)21-13-31(19-8-9-19)24(33)32(21)22-10-11-26-23(29-22)28-16(3)20-12-30(14-27-20)18-6-4-17(25)5-7-18/h4-7,10-12,14-16,19,21H,8-9,13H2,1-3H3,(H,26,28,29)/t16-,21+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445386
PNG
((S)-6-(2-(((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4...)
Show SMILES CC(C)[C@@H]1N(C(=O)NC11CC1)c1ccnc(N[C@@H](C)c2cn(cn2)-c2ccc(Cl)cc2)n1
Show InChI InChI=1S/C23H26ClN7O/c1-14(2)20-23(9-10-23)29-22(32)31(20)19-8-11-25-21(28-19)27-15(3)18-12-30(13-26-18)17-6-4-16(24)5-7-17/h4-8,11-15,20H,9-10H2,1-3H3,(H,29,32)(H,25,27,28)/t15-,20-/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445284
PNG
((S)-1-(2-((S)-1-(1-(4-chlorophenyl)-1H-imidazol-4-...)
Show SMILES C[C@H](Nc1nccc(n1)N1[C@H](CNC1=O)C1CC1)c1cn(cn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C21H22ClN7O/c1-13(17-11-28(12-25-17)16-6-4-15(22)5-7-16)26-20-23-9-8-19(27-20)29-18(14-2-3-14)10-24-21(29)30/h4-9,11-14,18H,2-3,10H2,1H3,(H,24,30)(H,23,26,27)/t13-,18+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445354
PNG
(US10682352, Compound 67 | Using the same manner as...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(c(Br)n2)-c2cccc(c2)C2CC2)n1
Show InChI InChI=1S/C26H30BrN7O/c1-16(2)20-14-32(3)25(35)34(20)22-9-12-28-24(30-22)31-26(10-11-26)21-15-33(23(27)29-21)19-6-4-5-18(13-19)17-7-8-17/h4-6,9,12-13,15-17,20H,7-8,10-11,14H2,1-3H3,(H,28,30,31)/t20-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445400
PNG
((S)-3-(2-(((S)-1-(1-(4-trifluoromethylphenyl)-1H-i...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2ccc(cn2)-c2ccnc(c2)C(F)(F)F)n1
Show InChI InChI=1S/C25H26F3N7O/c1-15(2)18-14-34(3)23(36)35(18)21-7-11-30-22(32-21)33-24(8-9-24)19-5-4-17(13-31-19)16-6-10-29-20(12-16)25(26,27)28/h4-7,10-13,15,18H,8-9,14H2,1-3H3,(H,30,32,33)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445274
PNG
((5S)-5-isopropyl-1-(2-((1-(4-phenoxyphenyl)ethyl)a...)
Show SMILES CC(C)[C@H]1CNC(=O)N1c1ccnc(NC(C)c2ccc(Oc3ccccc3)cc2)n1
Show InChI InChI=1S/C24H27N5O2/c1-16(2)21-15-26-24(30)29(21)22-13-14-25-23(28-22)27-17(3)18-9-11-20(12-10-18)31-19-7-5-4-6-8-19/h4-14,16-17,21H,15H2,1-3H3,(H,26,30)(H,25,27,28)/t17?,21-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445316
PNG
((S)-3-(2-((1-(1-(cyclopentylmethyl)-1H-imidazol-4-...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(NC2(CC2)c2cn(CC3CCCC3)cn2)n1
Show InChI InChI=1S/C23H33N7O/c1-16(2)18-13-28(3)22(31)30(18)20-8-11-24-21(26-20)27-23(9-10-23)19-14-29(15-25-19)12-17-6-4-5-7-17/h8,11,14-18H,4-7,9-10,12-13H2,1-3H3,(H,24,26,27)/t18-/m1/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

More data for this
Ligand-Target Pair
Isocitrate dehydrogenase [NADP] cytoplasmic


(Homo sapiens (Human))
BDBM445343
PNG
((S)-3-(2-(((S)-1-(1-(4,4-dimethylcyclohexyl)-1H-im...)
Show SMILES CC(C)[C@H]1CN(C)C(=O)N1c1ccnc(N[C@@H](C)c2cn(cn2)C2CCC(C)(C)CC2)n1
Show InChI InChI=1S/C24H37N7O/c1-16(2)20-14-29(6)23(32)31(20)21-9-12-25-22(28-21)27-17(3)19-13-30(15-26-19)18-7-10-24(4,5)11-8-18/h9,12-13,15-18,20H,7-8,10-11,14H2,1-6H3,(H,25,27,28)/t17-,20+/m0/s1
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SHANGHAI HAIHE PHARMACEUTICAL CO., LTD.; SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES

US Patent


Assay Description
Measurements were performed in a reaction volume of 15 uL using 384-well assay plates. Kinase enzyme, inhibitor, ATP and 1 uM peptide substrate were ...


US Patent US10682352 (2020)

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