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Patent code US10329300

Compile Data Set for Download or QSAR
Found 80 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
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376962
PNG
(US10329300, Example 50 | US9920060, 50)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1F
Show InChI InChI=1S/C24H26ClFN8O3/c1-4-16(35)33-9-5-6-14(11-33)34-23-18(22(27)28-12-29-23)21(31-34)24(37)30-15-8-7-13(20(26)19(15)25)10-17(36)32(2)3/h4,7-8,12,14H,1,5-6,9-11H2,2-3H3,(H,30,37)(H2,27,28,29)/t14-/m1/s1
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n/an/a 2.90n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376933
PNG
(US10329300, Example 27 | US9920060, 27)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1
Show InChI InChI=1S/C23H25ClN8O4/c1-4-17(33)31-9-5-6-13(11-31)32-21-18(20(25)26-12-27-21)19(29-32)22(34)28-16-8-7-14(10-15(16)24)36-23(35)30(2)3/h4,7-8,10,12-13H,1,5-6,9,11H2,2-3H3,(H,28,34)(H2,25,26,27)/t13-/m1/s1
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n/an/a 3.90n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376912
PNG
(US10329300, Example 6 | US9920060, 6)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1
Show InChI InChI=1S/C24H27ClN8O3/c1-4-18(34)32-9-5-6-15(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(36)29-17-8-7-14(10-16(17)25)11-19(35)31(2)3/h4,7-8,10,13,15H,1,5-6,9,11-12H2,2-3H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 4n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376924
PNG
(US10329300, Example 18 | US9920060, 18)
Show SMILES CN(C)C(=O)Cc1cc(Cl)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1F
Show InChI InChI=1S/C24H26ClFN8O3/c1-4-18(35)33-7-5-6-14(11-33)34-23-20(22(27)28-12-29-23)21(31-34)24(37)30-17-10-16(26)13(8-15(17)25)9-19(36)32(2)3/h4,8,10,12,14H,1,5-7,9,11H2,2-3H3,(H,30,37)(H2,27,28,29)/t14-/m1/s1
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n/an/a 4.40n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376920
PNG
(US10329300, Example 14 | US9920060, 14)
Show SMILES COc1c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)ccc(CC(=O)N(C)C)c1F
Show InChI InChI=1S/C25H29FN8O4/c1-5-17(35)33-10-6-7-15(12-33)34-24-19(23(27)28-13-29-24)21(31-34)25(37)30-16-9-8-14(11-18(36)32(2)3)20(26)22(16)38-4/h5,8-9,13,15H,1,6-7,10-12H2,2-4H3,(H,30,37)(H2,27,28,29)/t15-/m1/s1
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n/an/a 4.60n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376988
PNG
(US10329300, Example 76 | US9920060, 76)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CC(F)CN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1
Show InChI InChI=1S/C24H26ClFN8O3/c1-4-18(35)33-10-14(26)9-15(11-33)34-23-20(22(27)28-12-29-23)21(31-34)24(37)30-17-6-5-13(7-16(17)25)8-19(36)32(2)3/h4-7,12,14-15H,1,8-11H2,2-3H3,(H,30,37)(H2,27,28,29)/t14?,15-/m1/s1
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n/an/a 5n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376948
PNG
(US10329300, Example 36 | US9920060, 36)
Show SMILES COc1cc(OC(=O)N(C)C)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C24H28N8O5/c1-5-18(33)31-10-6-7-14(12-31)32-22-19(21(25)26-13-27-22)20(29-32)23(34)28-16-9-8-15(11-17(16)36-4)37-24(35)30(2)3/h5,8-9,11,13-14H,1,6-7,10,12H2,2-4H3,(H,28,34)(H2,25,26,27)/t14-/m1/s1
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n/an/a 5.40n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376923
PNG
(US10329300, Example 17 | US9920060, 17)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Br)c1
Show InChI InChI=1S/C24H27BrN8O3/c1-4-18(34)32-9-5-6-15(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(36)29-17-8-7-14(10-16(17)25)11-19(35)31(2)3/h4,7-8,10,13,15H,1,5-6,9,11-12H2,2-3H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 5.90n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376945
PNG
((R)-4-(1-(1-acryloylpiperidin-3-yl)-4-amino-1H-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c2ccccc12
Show InChI InChI=1S/C27H28N8O4/c1-4-21(36)34-13-7-8-16(14-34)35-25-22(24(28)29-15-30-25)23(32-35)26(37)31-19-11-12-20(39-27(38)33(2)3)18-10-6-5-9-17(18)19/h4-6,9-12,15-16H,1,7-8,13-14H2,2-3H3,(H,31,37)(H2,28,29,30)/t16-/m1/s1
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n/an/a 6n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376941
PNG
(US10329300, Example 29 | US9920060, 29)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C23H25ClN8O4/c1-4-17(33)31-9-5-6-14(11-31)32-21-18(20(25)26-12-27-21)19(29-32)22(34)28-13-7-8-16(15(24)10-13)36-23(35)30(2)3/h4,7-8,10,12,14H,1,5-6,9,11H2,2-3H3,(H,28,34)(H2,25,26,27)/t14-/m1/s1
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n/an/a 6.5n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376932
PNG
(US10329300, Example 26 | US9920060, 26)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C24H28N8O4/c1-5-18(33)31-10-6-7-15(12-31)32-22-19(21(25)26-13-27-22)20(29-32)23(34)28-17-9-8-16(11-14(17)2)36-24(35)30(3)4/h5,8-9,11,13,15H,1,6-7,10,12H2,2-4H3,(H,28,34)(H2,25,26,27)/t15-/m1/s1
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n/an/a 7n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376909
PNG
(US10329300, Example 3 | US9920060, 3)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1C
Show InChI InChI=1S/C25H29ClN8O3/c1-5-18(35)33-10-6-7-16(12-33)34-24-20(23(27)28-13-29-24)22(31-34)25(37)30-17-9-8-15(14(2)21(17)26)11-19(36)32(3)4/h5,8-9,13,16H,1,6-7,10-12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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n/an/a 7.10n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376913
PNG
(US10329300, Example 7 | US9920060, 7)
Show SMILES COc1cc(CC(=O)N(C)C)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C25H30N8O4/c1-5-19(34)32-10-6-7-16(13-32)33-24-21(23(26)27-14-28-24)22(30-33)25(36)29-17-9-8-15(11-18(17)37-4)12-20(35)31(2)3/h5,8-9,11,14,16H,1,6-7,10,12-13H2,2-4H3,(H,29,36)(H2,26,27,28)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376918
PNG
(US10329300, Example 12 | US9920060, 12)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1F
Show InChI InChI=1S/C25H29FN8O3/c1-5-18(35)33-10-6-7-16(12-33)34-24-20(23(27)28-13-29-24)22(31-34)25(37)30-17-9-8-15(21(26)14(17)2)11-19(36)32(3)4/h5,8-9,13,16H,1,6-7,10-12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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n/an/a 7.5n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376917
PNG
(US10329300, Example 11 | US9920060, 11)
Show SMILES COc1c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)ccc(CC(=O)N(C)C)c1Cl
Show InChI InChI=1S/C25H29ClN8O4/c1-5-17(35)33-10-6-7-15(12-33)34-24-19(23(27)28-13-29-24)21(31-34)25(37)30-16-9-8-14(11-18(36)32(2)3)20(26)22(16)38-4/h5,8-9,13,15H,1,6-7,10-12H2,2-4H3,(H,30,37)(H2,27,28,29)/t15-/m1/s1
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n/an/a 7.5n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376980
PNG
((R)-4-(1-(1-acryloylpyrimidin-3-yl)-4-amino-1H-pyr...)
Show SMILES CN(C(=O)Oc1ccc(NC(=O)c2nn(N3CN(CC=C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1)c1ccccc1
Show InChI InChI=1S/C28H27N9O4/c1-4-22(38)35-13-8-14-36(17-35)37-26-23(25(29)30-16-31-26)24(33-37)27(39)32-21-12-11-20(15-18(21)2)41-28(40)34(3)19-9-6-5-7-10-19/h4-12,14-16H,1,13,17H2,2-3H3,(H,32,39)(H2,29,30,31)
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n/an/a 7.70n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376908
PNG
(US10329300, Example 2 | US9920060, 2)
Show SMILES CN(C)C(=O)Cc1cc(Cl)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C
Show InChI InChI=1S/C25H29ClN8O3/c1-5-19(35)33-8-6-7-16(12-33)34-24-21(23(27)28-13-29-24)22(31-34)25(37)30-18-9-14(2)15(10-17(18)26)11-20(36)32(3)4/h5,9-10,13,16H,1,6-8,11-12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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n/an/a 8.30n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376960
PNG
(US10329300, Example 48 | US9920060, 48)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C=C)c1
Show InChI InChI=1S/C26H30N8O3/c1-5-17-12-16(13-21(36)32(3)4)9-10-19(17)30-26(37)23-22-24(27)28-15-29-25(22)34(31-23)18-8-7-11-33(14-18)20(35)6-2/h5-6,9-10,12,15,18H,1-2,7-8,11,13-14H2,3-4H3,(H,30,37)(H2,27,28,29)/t18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376921
PNG
(US10329300, Example 15 | US9920060, 15)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(OC(F)F)c1
Show InChI InChI=1S/C25H28F2N8O4/c1-4-18(36)34-9-5-6-15(12-34)35-23-20(22(28)29-13-30-23)21(32-35)24(38)31-16-8-7-14(11-19(37)33(2)3)10-17(16)39-25(26)27/h4,7-8,10,13,15,25H,1,5-6,9,11-12H2,2-3H3,(H,31,38)(H2,28,29,30)/t15-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376942
PNG
(US10329300, Example 30 | US9920060, 30)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C
Show InChI InChI=1S/C24H28N8O4/c1-5-18(33)31-10-6-7-16(12-31)32-22-19(21(25)26-13-27-22)20(29-32)23(34)28-15-8-9-17(14(2)11-15)36-24(35)30(3)4/h5,8-9,11,13,16H,1,6-7,10,12H2,2-4H3,(H,28,34)(H2,25,26,27)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376914
PNG
(US10329300, Example 8 | US9920060, 8)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C24H27ClN8O3/c1-4-18(34)32-9-5-6-16(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(36)29-15-8-7-14(17(25)11-15)10-19(35)31(2)3/h4,7-8,11,13,16H,1,5-6,9-10,12H2,2-3H3,(H,29,36)(H2,26,27,28)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376944
PNG
(US10329300, Example 32 | US9920060, 32)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1C
Show InChI InChI=1S/C25H30N8O4/c1-6-19(34)32-11-7-8-16(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(35)29-17-9-10-18(15(3)14(17)2)37-25(36)31(4)5/h6,9-10,13,16H,1,7-8,11-12H2,2-5H3,(H,29,35)(H2,26,27,28)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376922
PNG
(US10329300, Example 16 | US9920060, 16)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(OCF)c1
Show InChI InChI=1S/C25H29FN8O4/c1-4-19(35)33-9-5-6-16(12-33)34-24-21(23(27)28-14-29-24)22(31-34)25(37)30-17-8-7-15(10-18(17)38-13-26)11-20(36)32(2)3/h4,7-8,10,14,16H,1,5-6,9,11-13H2,2-3H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417103
PNG
((R)-4-(1-(1-acryloylpyrimidin-3-yl)-4-amino-1H-pyr...)
Show SMILES Cc1cc(OC(=O)N2CCCCC2)ccc1NC(=O)c1nn(N2CN(CC=C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C26H29N9O4/c1-3-20(36)33-12-7-13-34(16-33)35-24-21(23(27)28-15-29-24)22(31-35)25(37)30-19-9-8-18(14-17(19)2)39-26(38)32-10-5-4-6-11-32/h3,7-9,13-15H,1,4-6,10-12,16H2,2H3,(H,30,37)(H2,27,28,29)
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376950
PNG
(US10329300, Example 38 | US9920060, 38)
Show SMILES CN(C)C(=O)Oc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C
Show InChI InChI=1S/C25H30N8O4/c1-6-19(34)32-9-7-8-16(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(35)29-17-10-15(3)18(11-14(17)2)37-25(36)31(4)5/h6,10-11,13,16H,1,7-9,12H2,2-5H3,(H,29,35)(H2,26,27,28)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376915
PNG
(US10329300, Example 9 | US9920060, 9)
Show SMILES COc1cc(CC(=O)N(C)C)c(Cl)cc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C25H29ClN8O4/c1-5-19(35)33-8-6-7-15(12-33)34-24-21(23(27)28-13-29-24)22(31-34)25(37)30-17-11-16(26)14(9-18(17)38-4)10-20(36)32(2)3/h5,9,11,13,15H,1,6-8,10,12H2,2-4H3,(H,30,37)(H2,27,28,29)/t15-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376925
PNG
(US10329300, Example 19 | US9920060, 19)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C25H29ClN8O3/c1-5-19(35)33-8-6-7-16(12-33)34-24-21(23(27)28-13-29-24)22(31-34)25(37)30-18-11-17(26)15(9-14(18)2)10-20(36)32(3)4/h5,9,11,13,16H,1,6-8,10,12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376907
PNG
(US10329300, Example 1 | US9920060, 1)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Br
Show InChI InChI=1S/C25H29BrN8O3/c1-5-19(35)33-8-6-7-16(12-33)34-24-21(23(27)28-13-29-24)22(31-34)25(37)30-18-11-17(26)15(9-14(18)2)10-20(36)32(3)4/h5,9,11,13,16H,1,6-8,10,12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376911
PNG
(US10329300, Example 5 | US9920060, 5)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c2ccccc12
Show InChI InChI=1S/C28H30N8O3/c1-4-22(37)35-13-7-8-18(15-35)36-27-24(26(29)30-16-31-27)25(33-36)28(39)32-21-12-11-17(14-23(38)34(2)3)19-9-5-6-10-20(19)21/h4-6,9-12,16,18H,1,7-8,13-15H2,2-3H3,(H,32,39)(H2,29,30,31)/t18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376949
PNG
(US10329300, Example 37 | US9920060, 37)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c2ncccc12
Show InChI InChI=1S/C26H27N9O4/c1-4-19(36)34-12-6-7-15(13-34)35-24-20(23(27)29-14-30-24)22(32-35)25(37)31-17-9-10-18(39-26(38)33(2)3)16-8-5-11-28-21(16)17/h4-5,8-11,14-15H,1,6-7,12-13H2,2-3H3,(H,31,37)(H2,27,29,30)/t15-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376970
PNG
((R)-4-(1-(1-acryloylpyrrolidin-3-yl)-4-amino-1H-py...)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c2ccccc12
Show InChI InChI=1S/C26H26N8O4/c1-4-20(35)33-12-11-15(13-33)34-24-21(23(27)28-14-29-24)22(31-34)25(36)30-18-9-10-19(38-26(37)32(2)3)17-8-6-5-7-16(17)18/h4-10,14-15H,1,11-13H2,2-3H3,(H,30,36)(H2,27,28,29)/t15-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417105
PNG
((R)-1-(1-acryloylpiperidin-3-yl)-4-amino-N-(4-(2-m...)
Show SMILES CON(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C25H30N8O4/c1-5-19(34)32-10-6-7-17(13-32)33-24-21(23(26)27-14-28-24)22(30-33)25(36)29-18-9-8-16(11-15(18)2)12-20(35)31(3)37-4/h5,8-9,11,14,17H,1,6-7,10,12-13H2,2-4H3,(H,29,36)(H2,26,27,28)/t17-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376983
PNG
(US10329300, Example 71 | US9920060, 71)
Show SMILES Cc1cc(CC(=O)N2CCCC2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C27H32N8O3/c1-3-21(36)34-12-6-7-19(15-34)35-26-23(25(28)29-16-30-26)24(32-35)27(38)31-20-9-8-18(13-17(20)2)14-22(37)33-10-4-5-11-33/h3,8-9,13,16,19H,1,4-7,10-12,14-15H2,2H3,(H,31,38)(H2,28,29,30)/t19-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376946
PNG
(US10329300, Example 34 | US9920060, 34)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1F
Show InChI InChI=1S/C23H25FN8O4/c1-4-17(33)31-9-5-6-14(11-31)32-21-18(20(25)26-12-27-21)19(29-32)22(34)28-13-7-8-16(15(24)10-13)36-23(35)30(2)3/h4,7-8,10,12,14H,1,5-6,9,11H2,2-3H3,(H,28,34)(H2,25,26,27)/t14-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376910
PNG
(US10329300, Example 4 | US9920060, 4)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C25H30N8O3/c1-5-19(34)32-10-6-7-17(13-32)33-24-21(23(26)27-14-28-24)22(30-33)25(36)29-18-9-8-16(11-15(18)2)12-20(35)31(3)4/h5,8-9,11,14,17H,1,6-7,10,12-13H2,2-4H3,(H,29,36)(H2,26,27,28)/t17-/m1/s1
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n/an/a 12n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376916
PNG
(US10329300, Example 10 | US9920060, 10)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1F
Show InChI InChI=1S/C25H29FN8O3/c1-5-19(35)33-8-6-7-16(12-33)34-24-21(23(27)28-13-29-24)22(31-34)25(37)30-18-11-17(26)15(9-14(18)2)10-20(36)32(3)4/h5,9,11,13,16H,1,6-8,10,12H2,2-4H3,(H,30,37)(H2,27,28,29)/t16-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376964
PNG
(US10329300, Example 52 | US9920060, 52)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(c1)-c1ccoc1
Show InChI InChI=1S/C28H30N8O4/c1-4-22(37)35-10-5-6-19(14-35)36-27-24(26(29)30-16-31-27)25(33-36)28(39)32-21-8-7-17(13-23(38)34(2)3)12-20(21)18-9-11-40-15-18/h4,7-9,11-12,15-16,19H,1,5-6,10,13-14H2,2-3H3,(H,32,39)(H2,29,30,31)/t19-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376943
PNG
(US10329300, Example 31 | US9920060, 31)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(F)c1
Show InChI InChI=1S/C23H25FN8O4/c1-4-17(33)31-9-5-6-13(11-31)32-21-18(20(25)26-12-27-21)19(29-32)22(34)28-16-8-7-14(10-15(16)24)36-23(35)30(2)3/h4,7-8,10,12-13H,1,5-6,9,11H2,2-3H3,(H,28,34)(H2,25,26,27)/t13-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376919
PNG
(US10329300, Example 13 | US9920060, 13)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1C
Show InChI InChI=1S/C26H32N8O3/c1-6-20(35)33-11-7-8-18(13-33)34-25-22(24(27)28-14-29-25)23(31-34)26(37)30-19-10-9-17(15(2)16(19)3)12-21(36)32(4)5/h6,9-10,14,18H,1,7-8,11-13H2,2-5H3,(H,30,37)(H2,27,28,29)/t18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376989
PNG
(US10329300, Example 77 | US9920060, 77)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CC(F)CN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1C
Show InChI InChI=1S/C26H31FN8O3/c1-6-20(36)34-11-17(27)10-18(12-34)35-25-22(24(28)29-13-30-25)23(32-35)26(38)31-19-8-7-16(14(2)15(19)3)9-21(37)33(4)5/h6-8,13,17-18H,1,9-12H2,2-5H3,(H,31,38)(H2,28,29,30)/t17?,18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376973
PNG
((R)-1-(1-acryloylpyrrolidin-3-yl)-4-amino-N-(4-(2-...)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c2ccccc12
Show InChI InChI=1S/C27H28N8O3/c1-4-21(36)34-12-11-17(14-34)35-26-23(25(28)29-15-30-26)24(32-35)27(38)31-20-10-9-16(13-22(37)33(2)3)18-7-5-6-8-19(18)20/h4-10,15,17H,1,11-14H2,2-3H3,(H,31,38)(H2,28,29,30)/t17-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376926
PNG
(US10329300, Example 20 | US9920060, 20)
Show SMILES CN(C)C(=O)Cc1cc(Cl)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C24H26Cl2N8O3/c1-4-18(35)33-7-5-6-14(11-33)34-23-20(22(27)28-12-29-23)21(31-34)24(37)30-17-10-15(25)13(8-16(17)26)9-19(36)32(2)3/h4,8,10,12,14H,1,5-7,9,11H2,2-3H3,(H,30,37)(H2,27,28,29)/t14-/m1/s1
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n/an/a 13n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376965
PNG
(US10329300, Example 53 | US9920060, 53)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c2OCOc12
Show InChI InChI=1S/C25H28N8O5/c1-4-17(34)32-9-5-6-15(11-32)33-24-19(23(26)27-12-28-24)20(30-33)25(36)29-16-8-7-14(10-18(35)31(2)3)21-22(16)38-13-37-21/h4,7-8,12,15H,1,5-6,9-11,13H2,2-3H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376955
PNG
(US10329300, Example 43 | US9920060, 43)
Show SMILES CN(C)C(=O)Oc1c(F)cc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1F
Show InChI InChI=1S/C23H24F2N8O4/c1-4-16(34)32-7-5-6-13(10-32)33-21-17(20(26)27-11-28-21)18(30-33)22(35)29-12-8-14(24)19(15(25)9-12)37-23(36)31(2)3/h4,8-9,11,13H,1,5-7,10H2,2-3H3,(H,29,35)(H2,26,27,28)/t13-/m1/s1
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n/an/a 14n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417111
PNG
(1-((3R,5S)-1-acryloyl-5-methylpyrrolidin-3-yl)-4-a...)
Show SMILES C[C@H]1CN(C[C@@H]1n1nc(C(=O)Nc2ccc(CC(=O)N(C)C)cc2Cl)c2c(N)ncnc12)C(=O)C=C
Show InChI InChI=1S/C24H27ClN8O3/c1-5-18(34)32-10-13(2)17(11-32)33-23-20(22(26)27-12-28-23)21(30-33)24(36)29-16-7-6-14(8-15(16)25)9-19(35)31(3)4/h5-8,12-13,17H,1,9-11H2,2-4H3,(H,29,36)(H2,26,27,28)/t13-,17-/m0/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376947
PNG
(US10329300, Example 35 | US9920060, 35)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(F)c1F
Show InChI InChI=1S/C23H24F2N8O4/c1-4-15(34)32-9-5-6-12(10-32)33-21-16(20(26)27-11-28-21)19(30-33)22(35)29-13-7-8-14(18(25)17(13)24)37-23(36)31(2)3/h4,7-8,11-12H,1,5-6,9-10H2,2-3H3,(H,29,35)(H2,26,27,28)/t12-/m1/s1
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n/an/a 16n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376987
PNG
(US10329300, Example 75 | US9920060, 75)
Show SMILES Cc1cc(NC(=O)N2CCCC2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C26H31N9O3/c1-3-20(36)34-12-6-7-18(14-34)35-24-21(23(27)28-15-29-24)22(32-35)25(37)31-19-9-8-17(13-16(19)2)30-26(38)33-10-4-5-11-33/h3,8-9,13,15,18H,1,4-7,10-12,14H2,2H3,(H,30,38)(H,31,37)(H2,27,28,29)/t18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417112
PNG
(1-((3R,5S)-1-acryloyl-5-methylpyrrolidin-3-yl)-4-a...)
Show SMILES C[C@H]1CN(C[C@@H]1n1nc(C(=O)Nc2ccc(CC(=O)N(C)C)c(C)c2C)c2c(N)ncnc12)C(=O)C=C
Show InChI InChI=1S/C26H32N8O3/c1-7-20(35)33-11-14(2)19(12-33)34-25-22(24(27)28-13-29-25)23(31-34)26(37)30-18-9-8-17(15(3)16(18)4)10-21(36)32(5)6/h7-9,13-14,19H,1,10-12H2,2-6H3,(H,30,37)(H2,27,28,29)/t14-,19-/m0/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376963
PNG
(US10329300, Example 51 | US9920060, 51)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(c1)-c1ccco1
Show InChI InChI=1S/C28H30N8O4/c1-4-22(37)35-11-5-7-18(15-35)36-27-24(26(29)30-16-31-27)25(33-36)28(39)32-20-10-9-17(14-23(38)34(2)3)13-19(20)21-8-6-12-40-21/h4,6,8-10,12-13,16,18H,1,5,7,11,14-15H2,2-3H3,(H,32,39)(H2,29,30,31)/t18-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376986
PNG
(US10329300, Example 74 | US9920060, 74)
Show SMILES CN(C)C(=O)Nc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C24H29N9O3/c1-5-18(34)32-10-6-7-16(12-32)33-22-19(21(25)26-13-27-22)20(30-33)23(35)29-17-9-8-15(11-14(17)2)28-24(36)31(3)4/h5,8-9,11,13,16H,1,6-7,10,12H2,2-4H3,(H,28,36)(H,29,35)(H2,25,26,27)/t16-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376953
PNG
(US10329300, Example 41 | US9920060, 41)
Show SMILES CN(C)C(=O)Cc1ccnc2c(NC(=O)c3nn([C@@H]4CCCN(C4)C(=O)C=C)c4ncnc(N)c34)cccc12
Show InChI InChI=1S/C27H29N9O3/c1-4-20(37)35-12-6-7-17(14-35)36-26-22(25(28)30-15-31-26)24(33-36)27(39)32-19-9-5-8-18-16(10-11-29-23(18)19)13-21(38)34(2)3/h4-5,8-11,15,17H,1,6-7,12-14H2,2-3H3,(H,32,39)(H2,28,30,31)/t17-/m1/s1
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TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376954
PNG
(US10329300, Example 42 | US9920060, 42)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1F
Show InChI InChI=1S/C24H27FN8O3/c1-4-18(34)32-9-5-6-16(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(36)29-15-8-7-14(17(25)11-15)10-19(35)31(2)3/h4,7-8,11,13,16H,1,5-6,9-10,12H2,2-3H3,(H,29,36)(H2,26,27,28)/t16-/m1/s1
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n/an/a 18n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417099
PNG
((R,E)-4-(4-amino-1-(1-(4-dimethylamino)but-2-enoyl...)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CNCCC3C\C=C\C(=O)N(C)C)c3ncnc(N)c23)c2ccccc12
Show InChI InChI=1S/C30H35N9O4/c1-37(2)24(40)11-7-8-18-14-15-32-16-22(18)39-28-25(27(31)33-17-34-28)26(36-39)29(41)35-21-12-13-23(43-30(42)38(3)4)20-10-6-5-9-19(20)21/h5-7,9-13,17-18,22,32H,8,14-16H2,1-4H3,(H,35,41)(H2,31,33,34)/b11-7+/t18?,22-/m1/s1
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n/an/a 19n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376977
PNG
(US10329300, Example 65 | US9920060, 65)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1F
Show InChI InChI=1S/C23H24ClFN8O3/c1-4-15(34)32-8-7-13(10-32)33-22-17(21(26)27-11-28-22)20(30-33)23(36)29-14-6-5-12(19(25)18(14)24)9-16(35)31(2)3/h4-6,11,13H,1,7-10H2,2-3H3,(H,29,36)(H2,26,27,28)/t13-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376961
PNG
(US10329300, Example 49 | US9920060, 49)
Show SMILES CCc1cc(CC(=O)N(C)C)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C26H32N8O3/c1-5-17-12-16(13-21(36)32(3)4)9-10-19(17)30-26(37)23-22-24(27)28-15-29-25(22)34(31-23)18-8-7-11-33(14-18)20(35)6-2/h6,9-10,12,15,18H,2,5,7-8,11,13-14H2,1,3-4H3,(H,30,37)(H2,27,28,29)/t18-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376972
PNG
(US10329300, Example 60 | US9920060, 60)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C=C)c1
Show InChI InChI=1S/C25H28N8O3/c1-5-16-11-15(12-20(35)31(3)4)7-8-18(16)29-25(36)22-21-23(26)27-14-28-24(21)33(30-22)17-9-10-32(13-17)19(34)6-2/h5-8,11,14,17H,1-2,9-10,12-13H2,3-4H3,(H,29,36)(H2,26,27,28)/t17-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376929
PNG
(US10329300, Example 23 | US9920060, 23)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(c1)C#N
Show InChI InChI=1S/C25H27N9O3/c1-4-19(35)33-9-5-6-17(13-33)34-24-21(23(27)28-14-29-24)22(31-34)25(37)30-18-8-7-15(10-16(18)12-26)11-20(36)32(2)3/h4,7-8,10,14,17H,1,5-6,9,11,13H2,2-3H3,(H,30,37)(H2,27,28,29)/t17-/m1/s1
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n/an/a 20n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376931
PNG
(US10329300, Example 25 | US9920060, 25)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(F)c1
Show InChI InChI=1S/C24H27FN8O3/c1-4-18(34)32-9-5-6-15(12-32)33-23-20(22(26)27-13-28-23)21(30-33)24(36)29-17-8-7-14(10-16(17)25)11-19(35)31(2)3/h4,7-8,10,13,15H,1,5-6,9,11-12H2,2-3H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 21n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376968
PNG
(US10329300, Example 56 | US9920060, 56)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1F
Show InChI InChI=1S/C24H27FN8O3/c1-5-17(34)32-9-8-15(11-32)33-23-19(22(26)27-12-28-23)21(30-33)24(36)29-16-7-6-14(20(25)13(16)2)10-18(35)31(3)4/h5-7,12,15H,1,8-11H2,2-4H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 22n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376951
PNG
(US10329300, Example 39 | US9920060, 39)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C
Show InChI InChI=1S/C26H32N8O3/c1-6-20(35)33-9-7-8-18(13-33)34-25-22(24(27)28-14-29-25)23(31-34)26(37)30-19-11-15(2)17(10-16(19)3)12-21(36)32(4)5/h6,10-11,14,18H,1,7-9,12-13H2,2-5H3,(H,30,37)(H2,27,28,29)/t18-/m1/s1
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n/an/a 22n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376952
PNG
(US10329300, Example 40 | US9920060, 40)
Show SMILES COc1cc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)ccc1CC(=O)N(C)C
Show InChI InChI=1S/C25H30N8O4/c1-5-19(34)32-10-6-7-17(13-32)33-24-21(23(26)27-14-28-24)22(30-33)25(36)29-16-9-8-15(18(12-16)37-4)11-20(35)31(2)3/h5,8-9,12,14,17H,1,6-7,10-11,13H2,2-4H3,(H,29,36)(H2,26,27,28)/t17-/m1/s1
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n/an/a 23n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376927
PNG
((R)-4-(1-(1-acryloylpiperidin-3-yl)-4-amino-1H-pyr...)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1
Show InChI InChI=1S/C23H26N8O4/c1-4-17(32)30-11-5-6-15(12-30)31-21-18(20(24)25-13-26-21)19(28-31)22(33)27-14-7-9-16(10-8-14)35-23(34)29(2)3/h4,7-10,13,15H,1,5-6,11-12H2,2-3H3,(H,27,33)(H2,24,25,26)/t15-/m1/s1
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n/an/a 26n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376957
PNG
(US10329300, Example 45 | US9920060, 45)
Show SMILES CN(C)C(=O)Oc1c(Cl)cc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C23H24Cl2N8O4/c1-4-16(34)32-7-5-6-13(10-32)33-21-17(20(26)27-11-28-21)18(30-33)22(35)29-12-8-14(24)19(15(25)9-12)37-23(36)31(2)3/h4,8-9,11,13H,1,5-7,10H2,2-3H3,(H,29,35)(H2,26,27,28)/t13-/m1/s1
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n/an/a 28n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376969
PNG
(US10329300, Example 57 | US9920060, 57)
Show SMILES COc1c(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)ccc(CC(=O)N(C)C)c1F
Show InChI InChI=1S/C24H27FN8O4/c1-5-16(34)32-9-8-14(11-32)33-23-18(22(26)27-12-28-23)20(30-33)24(36)29-15-7-6-13(10-17(35)31(2)3)19(25)21(15)37-4/h5-7,12,14H,1,8-11H2,2-4H3,(H,29,36)(H2,26,27,28)/t14-/m1/s1
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n/an/a 31n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376966
PNG
(US10329300, Example 54 | US9920060, 54)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Cl)c1
Show InChI InChI=1S/C23H25ClN8O3/c1-4-17(33)31-8-7-14(11-31)32-22-19(21(25)26-12-27-22)20(29-32)23(35)28-16-6-5-13(9-15(16)24)10-18(34)30(2)3/h4-6,9,12,14H,1,7-8,10-11H2,2-3H3,(H,28,35)(H2,25,26,27)/t14-/m1/s1
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n/an/a 31n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376930
PNG
(US10329300, Example 24 | US9920060, 24)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C#N
Show InChI InChI=1S/C26H29N9O3/c1-5-20(36)34-8-6-7-18(13-34)35-25-22(24(28)29-14-30-25)23(32-35)26(38)31-19-10-17(12-27)16(9-15(19)2)11-21(37)33(3)4/h5,9-10,14,18H,1,6-8,11,13H2,2-4H3,(H,31,38)(H2,28,29,30)/t18-/m1/s1
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n/an/a 38n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376975
PNG
(US10329300, Example 63 | US9920060, 63)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C23H26N8O4/c1-5-17(32)30-9-8-14(11-30)31-21-18(20(24)25-12-26-21)19(28-31)22(33)27-16-7-6-15(10-13(16)2)35-23(34)29(3)4/h5-7,10,12,14H,1,8-9,11H2,2-4H3,(H,27,33)(H2,24,25,26)/t14-/m1/s1
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n/an/a 38n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376958
PNG
(US10329300, Example 46 | US9920060, 46)
Show SMILES CN(C)C(=O)Oc1c(C)cc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1C
Show InChI InChI=1S/C25H30N8O4/c1-6-18(34)32-9-7-8-17(12-32)33-23-19(22(26)27-13-28-23)20(30-33)24(35)29-16-10-14(2)21(15(3)11-16)37-25(36)31(4)5/h6,10-11,13,17H,1,7-9,12H2,2-5H3,(H,29,35)(H2,26,27,28)/t17-/m1/s1
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n/an/a 44n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376971
PNG
(US10329300, Example 59 | US9920060, 59)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1C
Show InChI InChI=1S/C25H30N8O3/c1-6-19(34)32-10-9-17(12-32)33-24-21(23(26)27-13-28-24)22(30-33)25(36)29-18-8-7-16(14(2)15(18)3)11-20(35)31(4)5/h6-8,13,17H,1,9-12H2,2-5H3,(H,29,36)(H2,26,27,28)/t17-/m1/s1
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n/an/a 45n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376934
PNG
(US10329300, Example 28 | US9920060, 28)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1
Show InChI InChI=1S/C24H28N8O3/c1-4-18(33)31-11-5-6-17(13-31)32-23-20(22(25)26-14-27-23)21(29-32)24(35)28-16-9-7-15(8-10-16)12-19(34)30(2)3/h4,7-10,14,17H,1,5-6,11-13H2,2-3H3,(H,28,35)(H2,25,26,27)/t17-/m1/s1
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n/an/a 46n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376956
PNG
(US10329300, Example 44 | US9920060, 44)
Show SMILES CN(C)C(=O)Oc1cc(C)c(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1
Show InChI InChI=1S/C25H30N8O4/c1-6-18(34)32-9-7-8-16(12-32)33-23-19(22(26)27-13-28-23)21(30-33)24(35)29-20-14(2)10-17(11-15(20)3)37-25(36)31(4)5/h6,10-11,13,16H,1,7-9,12H2,2-5H3,(H,29,35)(H2,26,27,28)/t16-/m1/s1
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n/an/a 46n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376928
PNG
(US10329300, Example 22 | US9920060, 22)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(c1)C1CC1
Show InChI InChI=1S/C27H32N8O3/c1-4-21(36)34-11-5-6-18(14-34)35-26-23(25(28)29-15-30-26)24(32-35)27(38)31-20-10-7-16(13-22(37)33(2)3)12-19(20)17-8-9-17/h4,7,10,12,15,17-18H,1,5-6,8-9,11,13-14H2,2-3H3,(H,31,38)(H2,28,29,30)/t18-/m1/s1
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n/an/a 48n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376976
PNG
(US10329300, Example 64 | US9920060, 64)
Show SMILES CN(C)C(=O)Oc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(C)c1C
Show InChI InChI=1S/C24H28N8O4/c1-6-18(33)31-10-9-15(11-31)32-22-19(21(25)26-12-27-22)20(29-32)23(34)28-16-7-8-17(14(3)13(16)2)36-24(35)30(4)5/h6-8,12,15H,1,9-11H2,2-5H3,(H,28,34)(H2,25,26,27)/t15-/m1/s1
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n/an/a 49n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376967
PNG
(US10329300, Example 55 | US9920060, 55)
Show SMILES COc1c(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)ccc(CC(=O)N(C)C)c1Cl
Show InChI InChI=1S/C24H27ClN8O4/c1-5-16(34)32-9-8-14(11-32)33-23-18(22(26)27-12-28-23)20(30-33)24(36)29-15-7-6-13(10-17(35)31(2)3)19(25)21(15)37-4/h5-7,12,14H,1,8-11H2,2-4H3,(H,29,36)(H2,26,27,28)/t14-/m1/s1
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n/an/a 49n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376959
PNG
(US10329300, Example 47 | US9920060, 47)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCCN(C3)C(=O)C=C)c3ncnc(N)c23)c(c1)N(C)C
Show InChI InChI=1S/C26H33N9O3/c1-6-20(36)34-11-7-8-17(14-34)35-25-22(24(27)28-15-29-25)23(31-35)26(38)30-18-10-9-16(12-19(18)32(2)3)13-21(37)33(4)5/h6,9-10,12,15,17H,1,7-8,11,13-14H2,2-5H3,(H,30,38)(H2,27,28,29)/t17-/m1/s1
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n/an/a 52n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417095
PNG
((R)-1-(1-acryloylpyrrolidin-3-yl)-4-amino-N-(2-bro...)
Show SMILES CN(C)C(=O)Cc1ccc(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)c(Br)c1
Show InChI InChI=1S/C23H25BrN8O3/c1-4-17(33)31-8-7-14(11-31)32-22-19(21(25)26-12-27-22)20(29-32)23(35)28-16-6-5-13(9-15(16)24)10-18(34)30(2)3/h4-6,9,12,14H,1,7-8,10-11H2,2-3H3,(H,28,35)(H2,25,26,27)/t14-/m1/s1
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n/an/a 59n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM139540
PNG
(US10189849, staurosporine | US10307427, Staurospor...)
Show SMILES CN[C@@H]1CC2OC([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1S/C27H24N4O3/c1-28-16-11-19-30-17-9-5-4-8-14(17)21-22-15(12-29-26(22)32)20-13-7-3-6-10-18(13)31(23(20)24(21)30)27(34-19)25(16)33-2/h3-10,16,19,25,27-28H,11-12H2,1-2H3,(H,29,32)/t16-,19?,25-,27?/m1/s1
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US Patent
n/an/a 63n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376979
PNG
(US10329300, Example 67 | US9920060, 67)
Show SMILES CN(C)C(=O)Cc1cc(C)c(NC(=O)c2nn([C@@H]3CCN(C3)C(=O)C=C)c3ncnc(N)c23)cc1Cl
Show InChI InChI=1S/C24H27ClN8O3/c1-5-18(34)32-7-6-15(11-32)33-23-20(22(26)27-12-28-23)21(30-33)24(36)29-17-10-16(25)14(8-13(17)2)9-19(35)31(3)4/h5,8,10,12,15H,1,6-7,9,11H2,2-4H3,(H,29,36)(H2,26,27,28)/t15-/m1/s1
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n/an/a 72n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM376985
PNG
(US10329300, Example 73 | US9920060, 73)
Show SMILES Cc1cc(CC(=O)N2CC(O)C2)ccc1NC(=O)c1nn([C@@H]2CCCN(C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C26H30N8O4/c1-3-20(36)32-8-4-5-17(11-32)34-25-22(24(27)28-14-29-25)23(31-34)26(38)30-19-7-6-16(9-15(19)2)10-21(37)33-12-18(35)13-33/h3,6-7,9,14,17-18,35H,1,4-5,8,10-13H2,2H3,(H,30,38)(H2,27,28,29)/t17-/m1/s1
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n/an/a 74n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM417102
PNG
((R)-4-(1-(1-acryloylpyrimidin-3-yl)-4-amino-1H-pyr...)
Show SMILES Cc1cc(OC(=O)N2CCCC2)ccc1NC(=O)c1nn(N2CN(CC=C2)C(=O)C=C)c2ncnc(N)c12
Show InChI InChI=1S/C25H27N9O4/c1-3-19(35)32-11-6-12-33(15-32)34-23-20(22(26)27-14-28-23)21(30-34)24(36)29-18-8-7-17(13-16(18)2)38-25(37)31-9-4-5-10-31/h3,6-8,12-14H,1,4-5,9-11,15H2,2H3,(H,29,36)(H2,26,27,28)
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n/an/a 92n/an/an/an/an/an/a



TAIHO PHARMACEUTICAL CO., LTD.

US Patent


Assay Description
For setting the conditions for the method for measuring the in vitro inhibitory activity of a compound against HER2-phosphorylating activity, Profile...


US Patent US10329300 (2019)


BindingDB Entry DOI: 10.7270/Q2MG7RWF
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%