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Patent code US10233189

Compile Data Set for Download or QSAR
Found 78 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
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370388
PNG
(US10233189, Example 81)
Show SMILES Cc1cc(NC(=O)c2c(C#CC3(O)CCCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C22H25N7O2/c1-13-11-15(28-27-13)26-20(30)16-14(5-8-22(31)6-3-4-7-22)29(21(2)9-10-21)19-17(16)18(23)24-12-25-19/h11-12,31H,3-4,6-7,9-10H2,1-2H3,(H2,23,24,25)(H2,26,27,28,30)
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US Patent
n/an/a 0.0400n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370382
PNG
(US10233189, Example 79)
Show SMILES Cc1cc(NC(=O)c2c(C#CC(C)(C)O)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C20H23N7O2/c1-11-9-13(26-25-11)24-18(28)14-12(5-6-19(2,3)29)27(20(4)7-8-20)17-15(14)16(21)22-10-23-17/h9-10,29H,7-8H2,1-4H3,(H2,21,22,23)(H2,24,25,26,28)
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US Patent
n/an/a 0.0700n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370385
PNG
(US10233189, Example 80)
Show SMILES Cc1cc(NC(=O)c2c(C#Cc3cccnc3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C22H20N8O/c1-13-10-16(29-28-13)27-21(31)17-15(6-5-14-4-3-9-24-11-14)30(22(2)7-8-22)20-18(17)19(23)25-12-26-20/h3-4,9-12H,7-8H2,1-2H3,(H2,23,25,26)(H2,27,28,29,31)
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n/an/a 0.0900n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370397
PNG
(US10233189, Example 84)
Show SMILES Cc1cc(NC(=O)c2c(C#CCN3CCOCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C22H26N8O2/c1-14-12-16(28-27-14)26-21(31)17-15(4-3-7-29-8-10-32-11-9-29)30(22(2)5-6-22)20-18(17)19(23)24-13-25-20/h12-13H,5-11H2,1-2H3,(H2,23,24,25)(H2,26,27,28,31)
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n/an/a 0.100n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370400
PNG
(US10233189, Example 85)
Show SMILES Cc1cc(NC(=O)c2c(C#CCC3(O)CCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C22H25N7O2/c1-13-11-15(28-27-13)26-20(30)16-14(5-3-6-22(31)7-4-8-22)29(21(2)9-10-21)19-17(16)18(23)24-12-25-19/h11-12,31H,4,6-10H2,1-2H3,(H2,23,24,25)(H2,26,27,28,30)
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n/an/a 0.100n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370372
PNG
(US10233189, Example 76)
Show SMILES Cc1cc(NC(=O)c2c(Br)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C15H16BrN7O/c1-7-5-8(22-21-7)20-14(24)9-10-12(17)18-6-19-13(10)23(11(9)16)15(2)3-4-15/h5-6H,3-4H2,1-2H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.140n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370341
PNG
(US10233189, Example 35)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C13H15BrN8O/c1-13(2,3)22-11-8(10(15)16-5-17-11)9(21-22)12(23)18-7-4-6(14)19-20-7/h4-5H,1-3H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370345
PNG
(US10233189, Example 67)
Show SMILES CC1(CC1)n1cc(C(=O)Nc2cc(Br)n[nH]2)c2c(N)ncnc12
Show InChI InChI=1S/C14H14BrN7O/c1-14(2-3-14)22-5-7(10-11(16)17-6-18-12(10)22)13(23)19-9-4-8(15)20-21-9/h4-6H,2-3H2,1H3,(H2,16,17,18)(H2,19,20,21,23)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370416
PNG
(US10233189, Example 63)
Show SMILES CC(C)(C)n1cc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C14H16BrN7O/c1-14(2,3)22-5-7(10-11(16)17-6-18-12(10)22)13(23)19-9-4-8(15)20-21-9/h4-6H,1-3H3,(H2,16,17,18)(H2,19,20,21,23)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370403
PNG
(US10233189, Example 86)
Show SMILES Cc1cc(NC(=O)c2c(C#CC3CCOCC3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C22H25N7O2/c1-13-11-16(28-27-13)26-21(30)17-15(4-3-14-5-9-31-10-6-14)29(22(2)7-8-22)20-18(17)19(23)24-12-25-20/h11-12,14H,5-10H2,1-2H3,(H2,23,24,25)(H2,26,27,28,30)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370342
PNG
(US10233189, Example 66)
Show SMILES CC(C)(CF)n1cc(C(=O)Nc2cc(Br)n[nH]2)c2c(N)ncnc12
Show InChI InChI=1S/C14H15BrFN7O/c1-14(2,5-16)23-4-7(10-11(17)18-6-19-12(10)23)13(24)20-9-3-8(15)21-22-9/h3-4,6H,5H2,1-2H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370379
PNG
(US10233189, Example 78)
Show SMILES Cc1cc(NC(=O)c2c(Cl)n(c3ncnc(N)c23)C(C)(C)CF)[nH]n1
Show InChI InChI=1S/C15H17ClFN7O/c1-7-4-8(23-22-7)21-14(25)9-10-12(18)19-6-20-13(10)24(11(9)16)15(2,3)5-17/h4,6H,5H2,1-3H3,(H2,18,19,20)(H2,21,22,23,25)
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n/an/a<0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370391
PNG
(US10233189, Example 82)
Show SMILES Cc1cc(NC(=O)c2c(C#Cc3cnn(C)c3)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C21H21N9O/c1-12-8-15(28-27-12)26-20(31)16-14(5-4-13-9-25-29(3)10-13)30(21(2)6-7-21)19-17(16)18(22)23-11-24-19/h8-11H,6-7H2,1-3H3,(H2,22,23,24)(H2,26,27,28,31)
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n/an/a 0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370369
PNG
(US10233189, Example 75)
Show SMILES Cc1cc(NC(=O)c2c(Cl)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C15H16ClN7O/c1-7-5-8(22-21-7)20-14(24)9-10-12(17)18-6-19-13(10)23(11(9)16)15(2)3-4-15/h5-6H,3-4H2,1-2H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a<0.150n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370384
PNG
(US10233189, Example 52)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C2CC2)n[nH]1
Show InChI InChI=1S/C16H20N8O/c1-8-6-10(22-21-8)20-15(25)12-11-13(17)18-7-19-14(11)24(23-12)16(2,3)9-4-5-9/h6-7,9H,4-5H2,1-3H3,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 0.160n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370381
PNG
(US10233189, Example 51)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C2(C)CC2)n[nH]1
Show InChI InChI=1S/C14H16N8O/c1-7-5-8(20-19-7)18-13(23)10-9-11(15)16-6-17-12(9)22(21-10)14(2)3-4-14/h5-6H,3-4H2,1-2H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 0.170n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370394
PNG
(US10233189, Example 83)
Show SMILES Cc1cc(NC(=O)c2c(C#Cc3cncn3C)n(c3ncnc(N)c23)C2(C)CC2)[nH]n1
Show InChI InChI=1S/C21H21N9O/c1-12-8-15(28-27-12)26-20(31)16-14(5-4-13-9-23-11-29(13)3)30(21(2)6-7-21)19-17(16)18(22)24-10-25-19/h8-11H,6-7H2,1-3H3,(H2,22,24,25)(H2,26,27,28,31)
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n/an/a 0.170n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370377
PNG
(US10233189, Example 50)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)CF)n[nH]1
Show InChI InChI=1S/C15H18FN7O/c1-8-4-10(22-21-8)20-14(24)9-5-23(15(2,3)6-16)13-11(9)12(17)18-7-19-13/h4-5,7H,6H2,1-3H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.200n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370362
PNG
(US10233189, Example 45 | US10233189, Example 48)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C)n[nH]1
Show InChI InChI=1S/C14H18N8O/c1-7-5-8(20-19-7)18-13(23)10-9-11(15)16-6-17-12(9)22(21-10)14(2,3)4/h5-6H,1-4H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 0.210n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370418
PNG
(US10233189, Example 65)
Show SMILES CC(C)n1cc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C13H14BrN7O/c1-6(2)21-4-7(10-11(15)16-5-17-12(10)21)13(22)18-9-3-8(14)19-20-9/h3-6H,1-2H3,(H2,15,16,17)(H2,18,19,20,22)
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n/an/a 0.230n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370390
PNG
(US10233189, Example 54)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C2(CF)CC2)n[nH]1
Show InChI InChI=1S/C14H15FN8O/c1-7-4-8(21-20-7)19-13(24)10-9-11(16)17-6-18-12(9)23(22-10)14(5-15)2-3-14/h4,6H,2-3,5H2,1H3,(H2,16,17,18)(H2,19,20,21,24)
PDB
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n/an/a 0.230n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370360
PNG
(US10233189, Example 72)
Show SMILES Cc1cc(NC(=O)c2cn(C3CCCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C16H19N7O/c1-9-6-12(22-21-9)20-16(24)11-7-23(10-4-2-3-5-10)15-13(11)14(17)18-8-19-15/h6-8,10H,2-5H2,1H3,(H2,17,18,19)(H2,20,21,22,24)
PDB
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n/an/a 0.266n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370402
PNG
(US10233189, Example 58)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C23CC(C2)C3)n[nH]1
Show InChI InChI=1S/C16H17N7O/c1-8-2-11(22-21-8)20-15(24)10-6-23(16-3-9(4-16)5-16)14-12(10)13(17)18-7-19-14/h2,6-7,9H,3-5H2,1H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.270n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370396
PNG
(US10233189, Example 56)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)c2cccs2)n[nH]1
Show InChI InChI=1S/C17H18N8OS/c1-9-7-11(23-22-9)21-16(26)13-12-14(18)19-8-20-15(12)25(24-13)17(2,3)10-5-4-6-27-10/h4-8H,1-3H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 0.279n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370417
PNG
(US10233189, Example 34)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C)[nH]n1
Show InChI InChI=1S/C14H18N8O/c1-7-5-8(20-19-7)18-13(23)10-9-11(15)16-6-17-12(9)22(21-10)14(2,3)4/h5-6H,1-4H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 0.290n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370363
PNG
(US10233189, Example 73)
Show SMILES Cc1cc(NC(=O)c2c(C)n(c3ncnc(N)c23)C(C)(C)C)[nH]n1
Show InChI InChI=1S/C16H21N7O/c1-8-6-10(22-21-8)20-15(24)11-9(2)23(16(3,4)5)14-12(11)13(17)18-7-19-14/h6-7H,1-5H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.320n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370348
PNG
(US10233189, Example 68)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C2(C)CCC2)n[nH]1
Show InChI InChI=1S/C16H19N7O/c1-9-6-11(22-21-9)20-15(24)10-7-23(16(2)4-3-5-16)14-12(10)13(17)18-8-19-14/h6-8H,3-5H2,1-2H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 0.337n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370393
PNG
(US10233189, Example 55)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C2(CC2)C(F)F)n[nH]1
Show InChI InChI=1S/C14H14F2N8O/c1-6-4-7(22-21-6)20-12(25)9-8-10(17)18-5-19-11(8)24(23-9)14(2-3-14)13(15)16/h4-5,13H,2-3H2,1H3,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 0.360n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370404
PNG
(US10233189, Example 28)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc(Br)[nH]n3)c12)C1CC2CCC1C2
Show InChI InChI=1/C16H17BrN8O/c17-10-5-11(23-22-10)21-16(26)13-12-14(18)19-6-20-15(12)25(24-13)9-4-7-1-2-8(9)3-7/h5-9H,1-4H2,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 0.400n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370357
PNG
(US10233189, Example 71)
Show SMILES Cc1cc(NC(=O)c2cn(C3CC4CCC3C4)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1/C18H21N7O/c1-9-4-14(24-23-9)22-18(26)12-7-25(13-6-10-2-3-11(13)5-10)17-15(12)16(19)20-8-21-17/h4,7-8,10-11,13H,2-3,5-6H2,1H3,(H2,19,20,21)(H2,22,23,24,26)
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n/an/a 0.400n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370401
PNG
(US10233189, Example 27)
Show SMILES Cc1cc(NC(=O)c2nn(C3CC4CCC3C4)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1/C17H20N8O/c1-8-4-12(23-22-8)21-17(26)14-13-15(18)19-7-20-16(13)25(24-14)11-6-9-2-3-10(11)5-9/h4,7,9-11H,2-3,5-6H2,1H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 0.430n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370351
PNG
(US10233189, Example 69)
Show SMILES Cc1cc(NC(=O)c2cn(C3CCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C15H17N7O/c1-8-5-11(21-20-8)19-15(23)10-6-22(9-3-2-4-9)14-12(10)13(16)17-7-18-14/h5-7,9H,2-4H2,1H3,(H2,16,17,18)(H2,19,20,21,23)
PDB
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n/an/a 0.460n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370365
PNG
(US10233189, Example 46)
Show SMILES CC(CF)n1nc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1/C13H15FN8O/c1-6-3-8(20-19-6)18-13(23)10-9-11(15)16-5-17-12(9)22(21-10)7(2)4-14/h3,5,7H,4H2,1-2H3,(H2,15,16,17)(H2,18,19,20,23)
PDB
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n/an/a 0.480n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370405
PNG
(US10233189, Example 59)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C2(C)CCCC2)n[nH]1
Show InChI InChI=1S/C17H21N7O/c1-10-7-12(23-22-10)21-16(25)11-8-24(17(2)5-3-4-6-17)15-13(11)14(18)19-9-20-15/h7-9H,3-6H2,1-2H3,(H2,18,19,20)(H2,21,22,23,25)
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n/an/a 0.510n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370368
PNG
(US10233189, Example 47)
Show SMILES Cc1cc(NC(=O)c2cn(C3CCC(C)(C)CC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C19H25N7O/c1-11-8-14(25-24-11)23-18(27)13-9-26(12-4-6-19(2,3)7-5-12)17-15(13)16(20)21-10-22-17/h8-10,12H,4-7H2,1-3H3,(H2,20,21,22)(H2,23,24,25,27)
PDB
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n/an/a 0.590n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370407
PNG
(US10233189, Example 29)
Show SMILES Cc1cc(NC(=O)c2nn(C3C4CC5CC(C4)CC3C5)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C20H24N8O/c1-9-2-14(26-25-9)24-20(29)16-15-18(21)22-8-23-19(15)28(27-16)17-12-4-10-3-11(6-12)7-13(17)5-10/h2,8,10-13,17H,3-7H2,1H3,(H2,21,22,23)(H2,24,25,26,29)
PDB
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n/an/a 0.610n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370366
PNG
(US10233189, Example 74)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C2(CC2)C2CC2)n[nH]1
Show InChI InChI=1S/C17H19N7O/c1-9-6-12(23-22-9)21-16(25)11-7-24(17(4-5-17)10-2-3-10)15-13(11)14(18)19-8-20-15/h6-8,10H,2-5H2,1H3,(H2,18,19,20)(H2,21,22,23,25)
PDB
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n/an/a 0.610n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370387
PNG
(US10233189, Example 53)
Show SMILES COCC(C)(C)n1nc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C15H20N8O2/c1-8-5-9(21-20-8)19-14(24)11-10-12(16)17-7-18-13(10)23(22-11)15(2,3)6-25-4/h5,7H,6H2,1-4H3,(H2,16,17,18)(H2,19,20,21,24)
PDB
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n/an/a 0.760n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370362
PNG
(US10233189, Example 45 | US10233189, Example 48)
Show SMILES Cc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C)n[nH]1
Show InChI InChI=1S/C14H18N8O/c1-7-5-8(20-19-7)18-13(23)10-9-11(15)16-6-17-12(9)22(21-10)14(2,3)4/h5-6H,1-4H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 0.788n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370354
PNG
(US10233189, Example 70)
Show SMILES CCC(C)(C)n1cc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C16H21N7O/c1-5-16(3,4)23-7-10(12-13(17)18-8-19-14(12)23)15(24)20-11-6-9(2)21-22-11/h6-8H,5H2,1-4H3,(H2,17,18,19)(H2,20,21,22,24)
PDB
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n/an/a 0.790n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370411
PNG
(US10233189, Example 61)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)C(C)(C)C)n[nH]1
Show InChI InChI=1S/C18H25N7O/c1-10-7-12(24-23-10)22-16(26)11-8-25(18(5,6)17(2,3)4)15-13(11)14(19)20-9-21-15/h7-9H,1-6H3,(H2,19,20,21)(H2,22,23,24,26)
PDB
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n/an/a 0.830n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370344
PNG
(US10233189, Example 36)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)C(F)(F)F)c2c(N)ncnc12
Show InChI InChI=1S/C14H15F3N8O/c1-13(2,3)25-11-8(10(18)19-5-20-11)9(24-25)12(26)21-7-4-6(22-23-7)14(15,16)17/h4-5H,1-3H3,(H2,18,19,20)(H2,21,22,23,26)
PDB
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n/an/a 1n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370398
PNG
(US10233189, Example 26)
Show SMILES Cc1cc(NC(=O)c2nn(C3CC(C)(C)C3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C16H20N8O/c1-8-4-10(22-21-8)20-15(25)12-11-13(17)18-7-19-14(11)24(23-12)9-5-16(2,3)6-9/h4,7,9H,5-6H2,1-3H3,(H2,17,18,19)(H2,20,21,22,25)
PDB
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n/an/a 1n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370389
PNG
(US10233189, Example 22)
Show SMILES CC(C)n1nc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C12H13BrN8O/c1-5(2)21-11-8(10(14)15-4-16-11)9(20-21)12(22)17-7-3-6(13)18-19-7/h3-5H,1-2H3,(H2,14,15,16)(H2,17,18,19,22)
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n/an/a 1.07n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370375
PNG
(US10233189, Example 77)
Show SMILES COc1c(C(=O)Nc2cc(C)n[nH]2)c2c(N)ncnc2n1C1(C)CC1
Show InChI InChI=1S/C16H19N7O2/c1-8-6-9(22-21-8)20-14(24)11-10-12(17)18-7-19-13(10)23(15(11)25-3)16(2)4-5-16/h6-7H,4-5H2,1-3H3,(H2,17,18,19)(H2,20,21,22,24)
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n/an/a 1.35n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370399
PNG
(US10233189, Example 57)
Show SMILES Cc1cc(NC(=O)c2cn(C3CCC(F)(F)C3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1/C16H17F2N7O/c1-8-4-11(24-23-8)22-15(26)10-6-25(9-2-3-16(17,18)5-9)14-12(10)13(19)20-7-21-14/h4,6-7,9H,2-3,5H2,1H3,(H2,19,20,21)(H2,22,23,24,26)
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n/an/a 1.47n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370350
PNG
(US10233189, Example 38)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)C#N)c2c(N)ncnc12
Show InChI InChI=1S/C14H15N9O/c1-14(2,3)23-12-9(11(16)17-6-18-12)10(22-23)13(24)19-8-4-7(5-15)20-21-8/h4,6H,1-3H3,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 1.48n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370353
PNG
(US10233189, Example 39)
Show SMILES CCc1cc(NC(=O)c2nn(c3ncnc(N)c23)C(C)(C)C)[nH]n1
Show InChI InChI=1S/C15H20N8O/c1-5-8-6-9(21-20-8)19-14(24)11-10-12(16)17-7-18-13(10)23(22-11)15(2,3)4/h6-7H,5H2,1-4H3,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 1.53n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370361
PNG
(US10233189, Example 11)
Show SMILES Cc1cc(NC(=O)c2nn(C3CCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C14H16N8O/c1-7-5-9(20-19-7)18-14(23)11-10-12(15)16-6-17-13(10)22(21-11)8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 1.73n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370415
PNG
(US10233189, Example 33)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc([nH]n3)C(F)F)c12)C1CCCCC1
Show InChI InChI=1S/C16H18F2N8O/c17-13(18)9-6-10(24-23-9)22-16(27)12-11-14(19)20-7-21-15(11)26(25-12)8-4-2-1-3-5-8/h6-8,13H,1-5H2,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 1.86n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370413
PNG
(US10233189, Example 32)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc(Br)[nH]n3)c12)C1CCCCC1
Show InChI InChI=1S/C15H17BrN8O/c16-9-6-10(22-21-9)20-15(25)12-11-13(17)18-7-19-14(11)24(23-12)8-4-2-1-3-5-8/h6-8H,1-5H2,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 1.86n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370340
PNG
(US10233189, Example 1)
Show SMILES CCc1cc(NC(=O)c2nn(C3CCCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C16H20N8O/c1-2-9-7-11(22-21-9)20-16(25)13-12-14(17)18-8-19-15(12)24(23-13)10-5-3-4-6-10/h7-8,10H,2-6H2,1H3,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 1.94n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370410
PNG
(US10233189, Example 31)
Show SMILES Cc1cc(NC(=O)c2nn(C(=C)CF)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C13H13FN8O/c1-6-3-8(20-19-6)18-13(23)10-9-11(15)16-5-17-12(9)22(21-10)7(2)4-14/h3,5H,2,4H2,1H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 1.97n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370386
PNG
(US10233189, Example 21)
Show SMILES CC(C)n1nc(C(=O)Nc2cc([nH]n2)C(F)(F)F)c2c(N)ncnc12
Show InChI InChI=1S/C13H13F3N8O/c1-5(2)24-11-8(10(17)18-4-19-11)9(23-24)12(25)20-7-3-6(21-22-7)13(14,15)16/h3-5H,1-2H3,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 2.03n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370392
PNG
(US10233189, Example 24)
Show SMILES Cc1cc(NC(=O)c2nn(C3CCC(C)(C)CC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C18H24N8O/c1-10-8-12(24-23-10)22-17(27)14-13-15(19)20-9-21-16(13)26(25-14)11-4-6-18(2,3)7-5-11/h8-9,11H,4-7H2,1-3H3,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 2.20n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370395
PNG
(US10233189, Example 25)
Show SMILES CC1(C)CCC(CC1)n1nc(C(=O)Nc2cc(Br)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C17H21BrN8O/c1-17(2)5-3-9(4-6-17)26-15-12(14(19)20-8-21-15)13(25-26)16(27)22-11-7-10(18)23-24-11/h7-9H,3-6H2,1-2H3,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 2.27n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370414
PNG
(US10233189, Example 62)
Show SMILES CC(C)C(C)(C)n1cc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1S/C17H23N7O/c1-9(2)17(4,5)24-7-11(13-14(18)19-8-20-15(13)24)16(25)21-12-6-10(3)22-23-12/h6-9H,1-5H3,(H2,18,19,20)(H2,21,22,23,25)
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n/an/a 2.27n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370380
PNG
(US10233189, Example 18)
Show SMILES Cc1cc(NC(=O)c2nn(CC3CC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C14H16N8O/c1-7-4-9(20-19-7)18-14(23)11-10-12(15)16-6-17-13(10)22(21-11)5-8-2-3-8/h4,6,8H,2-3,5H2,1H3,(H2,15,16,17)(H2,18,19,20,23)
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n/an/a 3.20n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370355
PNG
(US10233189, Example 8)
Show SMILES CCCc1cc(NC(=O)c2nn(C3CCCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C17H22N8O/c1-2-5-10-8-12(23-22-10)21-17(26)14-13-15(18)19-9-20-16(13)25(24-14)11-6-3-4-7-11/h8-9,11H,2-7H2,1H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 3.30n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370408
PNG
(US10233189, Example 60)
Show SMILES Cc1cc(NC(=O)c2cn(c3ncnc(N)c23)C(C)(C)c2ccccc2)n[nH]1
Show InChI InChI=1S/C20H21N7O/c1-12-9-15(26-25-12)24-19(28)14-10-27(18-16(14)17(21)22-11-23-18)20(2,3)13-7-5-4-6-8-13/h4-11H,1-3H3,(H2,21,22,23)(H2,24,25,26,28)
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n/an/a 3.51n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370376
PNG
(US10233189, Example 17)
Show SMILES Nc1ncnc2n(CC3CCC3)nc(C(=O)Nc3cc(Br)[nH]n3)c12
Show InChI InChI=1S/C14H15BrN8O/c15-8-4-9(21-20-8)19-14(24)11-10-12(16)17-6-18-13(10)23(22-11)5-7-2-1-3-7/h4,6-7H,1-3,5H2,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 4n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370359
PNG
(US10233189, Example 44)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc(Br)n[nH]3)c12)C1CCC(F)(F)CC1
Show InChI InChI=1S/C15H15BrF2N8O/c16-8-5-9(24-23-8)22-14(27)11-10-12(19)20-6-21-13(10)26(25-11)7-1-3-15(17,18)4-2-7/h5-7H,1-4H2,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 4.58n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370370
PNG
(US10233189, Example 15)
Show SMILES CCC(C)n1nc(C(=O)Nc2cc(C)[nH]n2)c2c(N)ncnc12
Show InChI InChI=1/C14H18N8O/c1-4-8(3)22-13-10(12(15)16-6-17-13)11(21-22)14(23)18-9-5-7(2)19-20-9/h5-6,8H,4H2,1-3H3,(H2,15,16,17)(H2,18,19,20,23)
PDB
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n/an/a 4.60n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370373
PNG
(US10233189, Example 16)
Show SMILES Cc1cc(NC(=O)c2nn(CC3CCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C15H18N8O/c1-8-5-10(21-20-8)19-15(24)12-11-13(16)17-7-18-14(11)23(22-12)6-9-3-2-4-9/h5,7,9H,2-4,6H2,1H3,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 4.96n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370347
PNG
(US10233189, Example 37 | US10233189, Example 49)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)-c2ccco2)c2c(N)ncnc12
Show InChI InChI=1S/C17H18N8O2/c1-17(2,3)25-15-12(14(18)19-8-20-15)13(24-25)16(26)21-11-7-9(22-23-11)10-5-4-6-27-10/h4-8H,1-3H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 5.13n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370383
PNG
(US10233189, Example 20)
Show SMILES Nc1ncnc2n(CC3CCCC3)nc(C(=O)Nc3cc(Br)[nH]n3)c12
Show InChI InChI=1S/C15H17BrN8O/c16-9-5-10(22-21-9)20-15(25)12-11-13(17)18-7-19-14(11)24(23-12)6-8-3-1-2-4-8/h5,7-8H,1-4,6H2,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 5.83n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370367
PNG
(US10233189, Example 13)
Show SMILES Cc1cc(NC(=O)c2nn(CC(F)(F)F)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C12H11F3N8O/c1-5-2-6(21-20-5)19-11(24)8-7-9(16)17-4-18-10(7)23(22-8)3-12(13,14)15/h2,4H,3H2,1H3,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 6.52n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370343
PNG
(US10233189, Example 2)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc([nH]n3)-c3ccco3)c12)C1CCCC1
Show InChI InChI=1S/C18H18N8O2/c19-16-14-15(25-26(10-4-1-2-5-10)17(14)21-9-20-16)18(27)22-13-8-11(23-24-13)12-6-3-7-28-12/h3,6-10H,1-2,4-5H2,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 6.66n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370346
PNG
(US10233189, Example 4)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc([nH]n3)-c3cccs3)c12)C1CCCC1
Show InChI InChI=1S/C18H18N8OS/c19-16-14-15(25-26(10-4-1-2-5-10)17(14)21-9-20-16)18(27)22-13-8-11(23-24-13)12-6-3-7-28-12/h3,6-10H,1-2,4-5H2,(H2,19,20,21)(H2,22,23,24,27)
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n/an/a 6.94n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370349
PNG
(US10233189, Example 5)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc([nH]n3)-c3ccccc3)c12)C1CCCC1
Show InChI InChI=1S/C20H20N8O/c21-18-16-17(27-28(13-8-4-5-9-13)19(16)23-11-22-18)20(29)24-15-10-14(25-26-15)12-6-2-1-3-7-12/h1-3,6-7,10-11,13H,4-5,8-9H2,(H2,21,22,23)(H2,24,25,26,29)
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n/an/a 7.79n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370364
PNG
(US10233189, Example 12)
Show SMILES Cc1cc(NC(=O)c2nn(CC3(C)CC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C15H18N8O/c1-8-5-9(21-20-8)19-14(24)11-10-12(16)17-7-18-13(10)23(22-11)6-15(2)3-4-15/h5,7H,3-4,6H2,1-2H3,(H2,16,17,18)(H2,19,20,21,24)
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n/an/a 8.24n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370352
PNG
(US10233189, Example 7)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3cc([nH]n3)C3CC3)c12)C1CCCC1
Show InChI InChI=1S/C17H20N8O/c18-15-13-14(17(26)21-12-7-11(22-23-12)9-5-6-9)24-25(10-3-1-2-4-10)16(13)20-8-19-15/h7-10H,1-6H2,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 8.5n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370356
PNG
(US10233189, Example 41)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc(n[nH]2)C2CC2)c2c(N)ncnc12
Show InChI InChI=1S/C16H20N8O/c1-16(2,3)24-14-11(13(17)18-7-19-14)12(23-24)15(25)20-10-6-9(21-22-10)8-4-5-8/h6-8H,4-5H2,1-3H3,(H2,17,18,19)(H2,20,21,22,25)
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n/an/a 10n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370358
PNG
(US10233189, Example 10)
Show SMILES CC(C)c1cc(NC(=O)c2nn(C3CCCC3)c3ncnc(N)c23)n[nH]1
Show InChI InChI=1S/C17H22N8O/c1-9(2)11-7-12(23-22-11)21-17(26)14-13-15(18)19-8-20-16(13)25(24-14)10-5-3-4-6-10/h7-10H,3-6H2,1-2H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 10.2n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370347
PNG
(US10233189, Example 37 | US10233189, Example 49)
Show SMILES CC(C)(C)n1nc(C(=O)Nc2cc([nH]n2)-c2ccco2)c2c(N)ncnc12
Show InChI InChI=1S/C17H18N8O2/c1-17(2,3)25-15-12(14(18)19-8-20-15)13(24-25)16(26)21-11-7-9(22-23-11)10-5-4-6-27-10/h4-8H,1-3H3,(H2,18,19,20)(H2,21,22,23,26)
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n/an/a 10.3n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370406
PNG
(US10233189, Example Compound-1-of-Comparative-Exam...)
Show SMILES Nc1ncnc2n(nc(C(=O)Nc3n[nH]c4cccc(F)c34)c12)C1CCCC1
Show InChI InChI=1S/C18H17FN8O/c19-10-6-3-7-11-12(10)16(25-24-11)23-18(28)14-13-15(20)21-8-22-17(13)27(26-14)9-4-1-2-5-9/h3,6-9H,1-2,4-5H2,(H2,20,21,22)(H2,23,24,25,28)
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n/an/a 451n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370412
PNG
(US10233189, Compound 3 of Comparative Examples)
Show SMILES Cc1c[nH]c(NC(=O)c2nn(C3CCC3)c3ncnc(N)c23)n1
Show InChI InChI=1S/C14H16N8O/c1-7-5-16-14(19-7)20-13(23)10-9-11(15)17-6-18-12(9)22(21-10)8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H2,15,17,18)(H2,16,19,20,23)
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n/an/a 486n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))
BDBM370409
PNG
(US10233189, Compound 2 of Comparative Examples)
Show SMILES Cc1csc(NC(=O)c2nn(C3CCC3)c3ncnc(N)c23)n1
Show InChI InChI=1S/C14H15N7OS/c1-7-5-23-14(18-7)19-13(22)10-9-11(15)16-6-17-12(9)21(20-10)8-3-2-4-8/h5-6,8H,2-4H2,1H3,(H2,15,16,17)(H,18,19,22)
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n/an/a 752n/an/an/an/an/an/a



Taiho Pharmaceutical Co., Ltd.

US Patent


Assay Description
To measure the inhibitory activity, first, the compounds of the present invention were individually diluted with dimethyl sulfoxide (DMSO) stepwise. ...


US Patent US10233189 (2019)

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