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Patent code US10053456

Compile Data Set for Download or QSAR

Found 375 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256623
PNG
(BDBM256647 | US10053456, 26 | US9487511, 2 | US971...)
Show SMILES Cc1nnc(NC(=O)c2cc(C3CC3NCC3CC3)c(C)s2)s1
Show InChI InChI=1S/C16H20N4OS2/c1-8-11(12-5-13(12)17-7-10-3-4-10)6-14(22-8)15(21)18-16-20-19-9(2)23-16/h6,10,12-13,17H,3-5,7H2,1-2H3,(H,18,20,21)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256624
PNG
(US10053456, 3 | US9487511, 3 | US9718814, 3)
Show SMILES Cn1nc(cc1C1CC1NCC1CC1)C(=O)NC1CCC(F)(F)CC1
Show InChI InChI=1S/C18H26F2N4O/c1-24-16(13-8-14(13)21-10-11-2-3-11)9-15(23-24)17(25)22-12-4-6-18(19,20)7-5-12/h9,11-14,21H,2-8,10H2,1H3,(H,22,25)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256625
PNG
(US10053456, 4 | US9487511, 4 | US9718814, 4)
Show SMILES Cn1nc(cc1C1CC1N)C(=O)NC1CCC(F)(F)CC1
Show InChI InChI=1S/C14H20F2N4O/c1-20-12(9-6-10(9)17)7-11(19-20)13(21)18-8-2-4-14(15,16)5-3-8/h7-10H,2-6,17H2,1H3,(H,18,21)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256626
PNG
(US10053456, 5 | US9487511, 5 | US9718814, 5)
Show SMILES Cc1nnc(NC(=O)c2cc(C3CC3N)c3ccccc3c2)s1
Show InChI InChI=1S/C17H16N4OS/c1-9-20-21-17(23-9)19-16(22)11-6-10-4-2-3-5-12(10)13(7-11)14-8-15(14)18/h2-7,14-15H,8,18H2,1H3,(H,19,21,22)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256627
PNG
(US10053456, 6 | US9487511, 6 | US9718814, 6)
Show SMILES Cc1nnc(NC(=O)c2cc(C3CC3NCC3CCOCC3)c3ccccc3c2)s1
Show InChI InChI=1S/C23H26N4O2S/c1-14-26-27-23(30-14)25-22(28)17-10-16-4-2-3-5-18(16)19(11-17)20-12-21(20)24-13-15-6-8-29-9-7-15/h2-5,10-11,15,20-21,24H,6-9,12-13H2,1H3,(H,25,27,28)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256643
PNG
(US10053456, 22 | US9487511, 22 | US9718814, 22)
Show SMILES Cc1sc(cc1C1CC1NC1CCC1)C(=O)Nc1cnn(C)c1
Show InChI InChI=1S/C17H22N4OS/c1-10-13(14-6-15(14)19-11-4-3-5-11)7-16(23-10)17(22)20-12-8-18-21(2)9-12/h7-9,11,14-15,19H,3-6H2,1-2H3,(H,20,22)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256644
PNG
(US10053456, 23 | US9487511, 23 | US9718814, 23)
Show SMILES Cc1nnc(NC(=O)c2csc(c2)C2CC2NCC2CC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)10-4-13(21-7-10)11-5-12(11)16-6-9-2-3-9/h4,7,9,11-12,16H,2-3,5-6H2,1H3,(H,17,19,20)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256644
PNG
(US10053456, 23 | US9487511, 23 | US9718814, 23)
Show SMILES Cc1nnc(NC(=O)c2csc(c2)C2CC2NCC2CC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)10-4-13(21-7-10)11-5-12(11)16-6-9-2-3-9/h4,7,9,11-12,16H,2-3,5-6H2,1H3,(H,17,19,20)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256623
PNG
(BDBM256647 | US10053456, 26 | US9487511, 2 | US971...)
Show SMILES Cc1nnc(NC(=O)c2cc(C3CC3NCC3CC3)c(C)s2)s1
Show InChI InChI=1S/C16H20N4OS2/c1-8-11(12-5-13(12)17-7-10-3-4-10)6-14(22-8)15(21)18-16-20-19-9(2)23-16/h6,10,12-13,17H,3-5,7H2,1-2H3,(H,18,20,21)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256650
PNG
(US10053456, 29 | US9487511, 29 | US9718814, 29)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1cc(cs1)C1CC1NC1CCOCC1
Show InChI InChI=1S/C19H26F2N2O2S/c20-19(21)5-1-13(2-6-19)23-18(24)17-9-12(11-26-17)15-10-16(15)22-14-3-7-25-8-4-14/h9,11,13-16,22H,1-8,10H2,(H,23,24)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256652
PNG
(US10053456, 31 | US9487511, 31 | US9718814, 31)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)C1CC1NC1CCOCC1
Show InChI InChI=1S/C19H26F2N2O2S/c20-19(21)5-1-13(2-6-19)23-18(24)12-9-17(26-11-12)15-10-16(15)22-14-3-7-25-8-4-14/h9,11,13-16,22H,1-8,10H2,(H,23,24)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256653
PNG
(US10053456, 32 | US9487511, 32 | US9718814, 32)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)C1CC1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256656
PNG
(US10053456, 35 | US9487511, 35 | US9718814, 35)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1nc(cs1)C1CC1NCC1CC1
Show InChI InChI=1S/C17H23F2N3OS/c18-17(19)5-3-11(4-6-17)21-15(23)16-22-14(9-24-16)12-7-13(12)20-8-10-1-2-10/h9-13,20H,1-8H2,(H,21,23)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243411
PNG
(5-((1R,2R)-2-(cis- (4-aminocyclohexyl)- amino)cycl...)
Show SMILES NC1CCC(CC1)N[C@@H]1C[C@H]1c1cc(cs1)C(=O)NC1CCC(F)(F)CC1
Show InChI InChI=1S/C20H29F2N3OS/c21-20(22)7-5-15(6-8-20)25-19(26)12-9-18(27-11-12)16-10-17(16)24-14-3-1-13(23)2-4-14/h9,11,13-17,24H,1-8,10,23H2,(H,25,26)/t13?,14?,16-,17-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243413
PNG
(5-((1R,2R)-2-((4,4- difluorocyclohexyl)- amino)cyc...)
Show SMILES FC1(F)CCC(CC1)N[C@@H]1C[C@H]1c1cc(cs1)C(=O)NC1CCOCC1
Show InChI InChI=1S/C19H26F2N2O2S/c20-19(21)5-1-13(2-6-19)22-16-10-15(16)17-9-12(11-26-17)18(24)23-14-3-7-25-8-4-14/h9,11,13-16,22H,1-8,10H2,(H,23,24)/t15-,16-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243418
PNG
(5-((1R,2R)-2- ((tetrahydro-2H- pyran-4-ylmethyl)- ...)
Show SMILES FC(F)(F)CN1CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NCC1CCOCC1
Show InChI InChI=1S/C21H30F3N3O2S/c22-21(23,24)13-27-5-1-16(2-6-27)26-20(28)15-9-19(30-12-15)17-10-18(17)25-11-14-3-7-29-8-4-14/h9,12,14,16-18,25H,1-8,10-11,13H2,(H,26,28)/t17-,18-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243419
PNG
(N-(2-methyl-1,3- thiazol-5-yl)-5- ((1R,2R)-2- ((te...)
Show SMILES Cc1ncc(NC(=O)c2csc(c2)[C@@H]2C[C@H]2NCC2CCOCC2)s1
Show InChI InChI=1S/C18H23N3O2S2/c1-11-19-9-17(25-11)21-18(22)13-6-16(24-10-13)14-7-15(14)20-8-12-2-4-23-5-3-12/h6,9-10,12,14-15,20H,2-5,7-8H2,1H3,(H,21,22)/t14-,15-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50153586
PNG
(CHEMBL3775474 | US10053456, 120 | US9718814, 71)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)[C@@H]1C[C@H]1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)/t14-,15-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM65039
PNG
(BDBM256703 | US10053456, 85 | US9487511, 116 | US9...)
Show SMILES Cc1nnc(NC(=O)c2cc(cs2)[C@H]2C[C@@H]2NC2CCC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)13-5-9(7-21-13)11-6-12(11)16-10-3-2-4-10/h5,7,10-12,16H,2-4,6H2,1H3,(H,17,19,20)/t11-,12+/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM244006
PNG
(5-((1R,2R)-2-((1- acetylpiperidin-4- yl)amino)cycl...)
Show SMILES CC(=O)N1CCC(CC1)N[C@@H]1C[C@H]1c1cc(cs1)C(=O)NC1CCC(F)(F)CC1
Show InChI InChI=1S/C21H29F2N3O2S/c1-13(27)26-8-4-16(5-9-26)24-18-11-17(18)19-10-14(12-29-19)20(28)25-15-2-6-21(22,23)7-3-15/h10,12,15-18,24H,2-9,11H2,1H3,(H,25,28)/t17-,18-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM244007
PNG
(5-((1R,2R)-2-((1- (cyclopropyl- carbonyl)piperidin...)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NC1CCN(CC1)C(=O)C1CC1
Show InChI InChI=1S/C23H31F2N3O2S/c24-23(25)7-3-16(4-8-23)27-21(29)15-11-20(31-13-15)18-12-19(18)26-17-5-9-28(10-6-17)22(30)14-1-2-14/h11,13-14,16-19,26H,1-10,12H2,(H,27,29)/t18-,19-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50153591
PNG
(CHEMBL3775711 | US10053456, 99 | US9487511, 99 | U...)
Show SMILES Cc1nnc(NC(=O)c2cc([C@@H]3C[C@H]3NC3CCC3)c(C)s2)s1
Show InChI InChI=1S/C16H20N4OS2/c1-8-11(12-6-13(12)17-10-4-3-5-10)7-14(22-8)15(21)18-16-20-19-9(2)23-16/h7,10,12-13,17H,3-6H2,1-2H3,(H,18,20,21)/t12-,13+/m0/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM244016
PNG
(4-((4-((((1R,2R)-2- (4-((4,4-difluoro- cyclohexyl)...)
Show SMILES OC(=O)c1ccc(CN2CCC(CN[C@@H]3C[C@H]3c3cc(cs3)C(=O)NC3CCC(F)(F)CC3)CC2)cc1
Show InChI InChI=1S/C28H35F2N3O3S/c29-28(30)9-5-22(6-10-28)32-26(34)21-13-25(37-17-21)23-14-24(23)31-15-18-7-11-33(12-8-18)16-19-1-3-20(4-2-19)27(35)36/h1-4,13,17-18,22-24,31H,5-12,14-16H2,(H,32,34)(H,35,36)/t23-,24-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256717
PNG
(US10053456, 103 | US9487511, 103 | US9718814, 103)
Show SMILES Cc1sc(cc1[C@H]1C[C@@H]1NCC1CC1)C(=O)Nc1cnn(C)c1
Show InChI InChI=1S/C17H22N4OS/c1-10-13(14-5-15(14)18-7-11-3-4-11)6-16(23-10)17(22)20-12-8-19-21(2)9-12/h6,8-9,11,14-15,18H,3-5,7H2,1-2H3,(H,20,22)/t14-,15+/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256718
PNG
(US10053456, 105 | US9487511, 105 | US9718814, 105)
Show SMILES Cc1sc(cc1[C@H]1C[C@@H]1NC1CCC1)C(=O)Nc1cnn(C)c1
Show InChI InChI=1S/C17H22N4OS/c1-10-13(14-6-15(14)19-11-4-3-5-11)7-16(23-10)17(22)20-12-8-18-21(2)9-12/h7-9,11,14-15,19H,3-6H2,1-2H3,(H,20,22)/t14-,15+/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50153586
PNG
(CHEMBL3775474 | US10053456, 120 | US9718814, 71)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)[C@@H]1C[C@H]1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)/t14-,15-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM50153586
PNG
(CHEMBL3775474 | US10053456, 120 | US9718814, 71)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)[C@@H]1C[C@H]1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)/t14-,15-/m1/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256726
PNG
(US10053456, 121 | US9487511, 121 | US9718814, 121)
Show SMILES Cc1sc(cc1[C@@H]1C[C@H]1NCC1CCC1)C(=O)Nc1cnn(C)c1
Show InChI InChI=1S/C18H24N4OS/c1-11-14(15-6-16(15)19-8-12-4-3-5-12)7-17(24-11)18(23)21-13-9-20-22(2)10-13/h7,9-10,12,15-16,19H,3-6,8H2,1-2H3,(H,21,23)/t15-,16+/m0/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256728
PNG
(US10053456, 124 | US9487511, 124 | US9718814, 124)
Show SMILES Cc1nnc(NC(=O)c2cc(cs2)[C@@H]2C[C@H]2N)s1
Show InChI InChI=1S/C11H12N4OS2/c1-5-14-15-11(18-5)13-10(16)9-2-6(4-17-9)7-3-8(7)12/h2,4,7-8H,3,12H2,1H3,(H,13,15,16)/t7-,8+/m0/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256729
PNG
(US10053456, 125 | US9487511, 125 | US9718814, 125)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)[C@H]1C[C@@H]1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)12-7-16(22-10-12)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)/t14-,15-/m0/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256626
PNG
(US10053456, 5 | US9487511, 5 | US9718814, 5)
Show SMILES Cc1nnc(NC(=O)c2cc(C3CC3N)c3ccccc3c2)s1
Show InChI InChI=1S/C17H16N4OS/c1-9-20-21-17(23-9)19-16(22)11-6-10-4-2-3-5-12(10)13(7-11)14-8-15(14)18/h2-7,14-15H,8,18H2,1H3,(H,19,21,22)
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US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256636
PNG
(US10053456, 15 | US9487511, 15 | US9718814, 15)
Show SMILES Cc1nnc(NC(=O)c2cc(cc3ccccc23)C2CC2N)s1
Show InChI InChI=1S/C17H16N4OS/c1-9-20-21-17(23-9)19-16(22)14-7-11(13-8-15(13)18)6-10-4-2-3-5-12(10)14/h2-7,13,15H,8,18H2,1H3,(H,19,21,22)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256646
PNG
(US10053456, 25 | US9487511, 25 | US9718814, 25)
Show SMILES Cc1sc(cc1C1CC1N)C(=O)Nc1cnn(C)c1
Show InChI InChI=1S/C13H16N4OS/c1-7-9(10-3-11(10)14)4-12(19-7)13(18)16-8-5-15-17(2)6-8/h4-6,10-11H,3,14H2,1-2H3,(H,16,18)
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US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256648
PNG
(US10053456, 27 | US9487511, 27 | US9718814, 27)
Show SMILES Cc1nnc(NC(=O)c2cc(cs2)C2CC2NCC2CC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)13-4-10(7-21-13)11-5-12(11)16-6-9-2-3-9/h4,7,9,11-12,16H,2-3,5-6H2,1H3,(H,17,19,20)
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US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256651
PNG
(US10053456, 30 | US9487511, 30 | US9718814, 30)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)C1CC1NCC1CC1
Show InChI InChI=1S/C18H24F2N2OS/c19-18(20)5-3-13(4-6-18)22-17(23)12-7-16(24-10-12)14-8-15(14)21-9-11-1-2-11/h7,10-11,13-15,21H,1-6,8-9H2,(H,22,23)
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US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243408
PNG
(5-((1R,2R)-2- (cyclobutylamino)- cyclopropyl)-N- (...)
Show SMILES O=C(NC1CCOCC1)c1csc(c1)C1CC1NC1CCC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-4-6-21-7-5-13)11-8-16(22-10-11)14-9-15(14)18-12-2-1-3-12/h8,10,12-15,18H,1-7,9H2,(H,19,20)
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Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM243410
PNG
(N-(4,4- difluorocyclohexyl)- 5-((1R,2R)-2- (tetrah...)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NC1CCOCC1
Show InChI InChI=1S/C19H26F2N2O2S/c20-19(21)5-1-13(2-6-19)23-18(24)12-9-17(26-11-12)15-10-16(15)22-14-3-7-25-8-4-14/h9,11,13-16,22H,1-8,10H2,(H,23,24)/t15-,16-/m1/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM243416
PNG
(N-(2-methyl-1,3- thiazol-5-yl)-5- ((1R,2R)-2- (tet...)
Show SMILES Cc1ncc(NC(=O)c2csc(c2)[C@@H]2C[C@H]2NC2CCOCC2)s1
Show InChI InChI=1S/C17H21N3O2S2/c1-10-18-8-16(24-10)20-17(21)11-6-15(23-9-11)13-7-14(13)19-12-2-4-22-5-3-12/h6,8-9,12-14,19H,2-5,7H2,1H3,(H,20,21)/t13-,14-/m1/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM243417
PNG
(N-(4,4- difluorocyclohexyl)- 5-((1R,2R)-2- ((tetra...)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NCC1CCOCC1
Show InChI InChI=1S/C20H28F2N2O2S/c21-20(22)5-1-15(2-6-20)24-19(25)14-9-18(27-12-14)16-10-17(16)23-11-13-3-7-26-8-4-13/h9,12-13,15-17,23H,1-8,10-11H2,(H,24,25)/t16-,17-/m1/s1
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US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256678
PNG
(US10053456, 57 | US9487511, 57 | US9718814, 57)
Show SMILES Cc1nnc(NC(=O)c2cc(cs2)C2CC2NC2CCC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)13-5-9(7-21-13)11-6-12(11)16-10-3-2-4-10/h5,7,10-12,16H,2-4,6H2,1H3,(H,17,19,20)
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US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM243426
PNG
(3-(4-((((1R,2R)-2- (4-((5-methyl-1,3,4- thiadiazol...)
Show SMILES Cc1nnc(NC(=O)c2csc(c2)[C@@H]2C[C@H]2NCC2CCN(CCC(O)=O)CC2)s1
Show InChI InChI=1S/C20H27N5O3S2/c1-12-23-24-20(30-12)22-19(28)14-8-17(29-11-14)15-9-16(15)21-10-13-2-5-25(6-3-13)7-4-18(26)27/h8,11,13,15-16,21H,2-7,9-10H2,1H3,(H,26,27)(H,22,24,28)/t15-,16-/m1/s1
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256685
PNG
(US10053456, 64 | US9487511, 64 | US9718814, 64)
Show SMILES O=C(NC1CCOCC1)c1cc(cs1)C1CC1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)16-7-12(10-22-16)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)
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Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256685
PNG
(US10053456, 64 | US9487511, 64 | US9718814, 64)
Show SMILES O=C(NC1CCOCC1)c1cc(cs1)C1CC1NCC1CC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-3-5-21-6-4-13)16-7-12(10-22-16)14-8-15(14)18-9-11-1-2-11/h7,10-11,13-15,18H,1-6,8-9H2,(H,19,20)
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US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256687
PNG
(US10053456, 66 | US9487511, 66 | US9718814, 66)
Show SMILES Cc1sc(cc1C(=O)NC1CCC(F)(F)CC1)C1CC1NCC1CCOCC1
Show InChI InChI=1S/C21H30F2N2O2S/c1-13-16(20(26)25-15-2-6-21(22,23)7-3-15)11-19(28-13)17-10-18(17)24-12-14-4-8-27-9-5-14/h11,14-15,17-18,24H,2-10,12H2,1H3,(H,25,26)
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256693
PNG
(US10053456, 73 | US9487511, 73 | US9718814, 73)
Show SMILES O=C(NC1CCOCC1)c1cc(cs1)[C@H]1C[C@@H]1NC1CCC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-4-6-21-7-5-13)16-8-11(10-22-16)14-9-15(14)18-12-2-1-3-12/h8,10,12-15,18H,1-7,9H2,(H,19,20)/t14-,15+/m1/s1
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US Patent
n/an/a>1.00E+5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM256693
PNG
(US10053456, 73 | US9487511, 73 | US9718814, 73)
Show SMILES O=C(NC1CCOCC1)c1cc(cs1)[C@H]1C[C@@H]1NC1CCC1
Show InChI InChI=1S/C17H24N2O2S/c20-17(19-13-4-6-21-7-5-13)16-8-11(10-22-16)14-9-15(14)18-12-2-1-3-12/h8,10,12-15,18H,1-7,9H2,(H,19,20)/t14-,15+/m1/s1
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n/an/a>1.00E+5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM243995
PNG
(5-((1R,2R)-2-((1- cyclopropyl- piperidin-4-yl)- am...)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NC1CCN(CC1)C1CC1
Show InChI InChI=1S/C22H31F2N3OS/c23-22(24)7-3-15(4-8-22)26-21(28)14-11-20(29-13-14)18-12-19(18)25-16-5-9-27(10-6-16)17-1-2-17/h11,13,15-19,25H,1-10,12H2,(H,26,28)/t18-,19-/m1/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM243995
PNG
(5-((1R,2R)-2-((1- cyclopropyl- piperidin-4-yl)- am...)
Show SMILES FC1(F)CCC(CC1)NC(=O)c1csc(c1)[C@@H]1C[C@H]1NC1CCN(CC1)C1CC1
Show InChI InChI=1S/C22H31F2N3OS/c23-22(24)7-3-15(4-8-22)26-21(28)14-11-20(29-13-14)18-12-19(18)25-16-5-9-27(10-6-16)17-1-2-17/h11,13,15-19,25H,1-10,12H2,(H,26,28)/t18-,19-/m1/s1
PDB

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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] B


(Homo sapiens (Human))
BDBM50153587
PNG
(CHEMBL3775248 | US10053456, 82 | US9487511, 82 | U...)
Show SMILES Cc1nnc(NC(=O)c2cc(cs2)[C@@H]2C[C@H]2NCC2CC2)s1
Show InChI InChI=1S/C15H18N4OS2/c1-8-18-19-15(22-8)17-14(20)13-4-10(7-21-13)11-5-12(11)16-6-9-2-3-9/h4,7,9,11-12,16H,2-3,5-6H2,1H3,(H,17,19,20)/t11-,12+/m0/s1
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US Patent
n/an/a>1.00E+5n/an/an/an/a7.525



Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-B inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A


(Homo sapiens (Human))
BDBM256705
PNG
(US10053456, 87 | US9487511, 87 | US9718814, 87)
Show SMILES Cn1cc(NC(=O)c2cc(cs2)[C@@H]2C[C@H]2NCC2CC2)cn1
Show InChI InChI=1S/C16H20N4OS/c1-20-8-12(7-18-20)19-16(21)15-4-11(9-22-15)13-5-14(13)17-6-10-2-3-10/h4,7-10,13-14,17H,2-3,5-6H2,1H3,(H,19,21)/t13-,14+/m0/s1
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Takeda Pharmaceutical Company Limited

US Patent


Assay Description
The MAO-A inhibitory activity evaluation described below followed the protocol of MAO-Glo (registered trademark) Assay of Promega KK.A test compound ...


US Patent US10053456 (2018)

More data for this
Ligand-Target Pair
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