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Patent code US9365575

Compile Data Set for Download or QSAR
Found 25 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
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236231
PNG
(US9365575, 9)
Show SMILES Brc1cccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)c1
Show InChI InChI=1S/C24H20BrN5O2/c25-17-4-3-5-19(12-17)28-23(31)27-18-10-8-15(9-11-18)16-13-26-22-20-6-1-2-7-21(20)29-24(32)30(22)14-16/h1-12,16H,13-14H2,(H,29,32)(H2,27,28,31)
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n/an/a 250n/an/an/an/an/an/a



Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236232
PNG
(US9365575, 10)
Show SMILES Cc1cccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)c1
Show InChI InChI=1S/C25H23N5O2/c1-16-5-4-6-20(13-16)28-24(31)27-19-11-9-17(10-12-19)18-14-26-23-21-7-2-3-8-22(21)29-25(32)30(23)15-18/h2-13,18H,14-15H2,1H3,(H,29,32)(H2,27,28,31)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236229
PNG
(US9365575, 7)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)ccc1Cl
Show InChI InChI=1S/C25H19ClF3N5O2/c26-20-10-9-17(11-19(20)25(27,28)29)32-23(35)31-16-7-5-14(6-8-16)15-12-30-22-18-3-1-2-4-21(18)33-24(36)34(22)13-15/h1-11,15H,12-13H2,(H,33,36)(H2,31,32,35)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236227
PNG
(US9365575, 5)
Show SMILES Fc1ccc(cc1NC(=O)Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21)C(F)(F)F
Show InChI InChI=1S/C25H19F4N5O2/c26-19-10-7-16(25(27,28)29)11-21(19)32-23(35)31-17-8-5-14(6-9-17)15-12-30-22-18-3-1-2-4-20(18)33-24(36)34(22)13-15/h1-11,15H,12-13H2,(H,33,36)(H2,31,32,35)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236247
PNG
(US9365575, 25)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(C3CN=C4N(C3)C(=O)Nc3ccccc43)c(C)c2)c1
Show InChI InChI=1S/C26H24FN5O2/c1-15-7-10-21(27)23(11-15)30-25(33)29-18-8-9-19(16(2)12-18)17-13-28-24-20-5-3-4-6-22(20)31-26(34)32(24)14-17/h3-12,17H,13-14H2,1-2H3,(H,31,34)(H2,29,30,33)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236225
PNG
(US9365575, 3)
Show SMILES Fc1ccc(cc1NC(=O)Nc1cccc(c1)C1CN=C2N(C1)C(=O)Nc1ccccc21)C(F)(F)F
Show InChI InChI=1S/C25H19F4N5O2/c26-19-9-8-16(25(27,28)29)11-21(19)32-23(35)31-17-5-3-4-14(10-17)15-12-30-22-18-6-1-2-7-20(18)33-24(36)34(22)13-15/h1-11,15H,12-13H2,(H,33,36)(H2,31,32,35)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236235
PNG
(US9365575, 13)
Show SMILES COc1cccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)c1
Show InChI InChI=1S/C25H23N5O3/c1-33-20-6-4-5-19(13-20)28-24(31)27-18-11-9-16(10-12-18)17-14-26-23-21-7-2-3-8-22(21)29-25(32)30(23)15-17/h2-13,17H,14-15H2,1H3,(H,29,32)(H2,27,28,31)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236246
PNG
(US9365575, 24)
Show SMILES Cc1cccc(NC(=O)Nc2ccc(C3CN=C4N(C3)C(=O)Nc3ccccc43)c(C)c2)c1
Show InChI InChI=1S/C26H25N5O2/c1-16-6-5-7-19(12-16)28-25(32)29-20-10-11-21(17(2)13-20)18-14-27-24-22-8-3-4-9-23(22)30-26(33)31(24)15-18/h3-13,18H,14-15H2,1-2H3,(H,30,33)(H2,28,29,32)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236230
PNG
(US9365575, 8)
Show SMILES CSc1cccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)c1
Show InChI InChI=1S/C25H23N5O2S/c1-33-20-6-4-5-19(13-20)28-24(31)27-18-11-9-16(10-12-18)17-14-26-23-21-7-2-3-8-22(21)29-25(32)30(23)15-17/h2-13,17H,14-15H2,1H3,(H,29,32)(H2,27,28,31)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236233
PNG
(US9365575, 11)
Show SMILES Cc1ccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)cc1
Show InChI InChI=1S/C25H23N5O2/c1-16-6-10-19(11-7-16)27-24(31)28-20-12-8-17(9-13-20)18-14-26-23-21-4-2-3-5-22(21)29-25(32)30(23)15-18/h2-13,18H,14-15H2,1H3,(H,29,32)(H2,27,28,31)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236228
PNG
(US9365575, 6)
Show SMILES O=C(Nc1ccccc1)Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C24H21N5O2/c30-23(26-18-6-2-1-3-7-18)27-19-12-10-16(11-13-19)17-14-25-22-20-8-4-5-9-21(20)28-24(31)29(22)15-17/h1-13,17H,14-15H2,(H,28,31)(H2,26,27,30)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236237
PNG
(US9365575, 15)
Show SMILES Cc1ccoc1C(=O)Nc1cccc(c1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C23H20N4O3/c1-14-9-10-30-20(14)22(28)25-17-6-4-5-15(11-17)16-12-24-21-18-7-2-3-8-19(18)26-23(29)27(21)13-16/h2-11,16H,12-13H2,1H3,(H,25,28)(H,26,29)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236242
PNG
(US9365575, 20)
Show SMILES CN1CCN(CC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)CC1
Show InChI InChI=1S/C24H28N6O2/c1-28-10-12-29(13-11-28)16-22(31)26-19-8-6-17(7-9-19)18-14-25-23-20-4-2-3-5-21(20)27-24(32)30(23)15-18/h2-9,18H,10-16H2,1H3,(H,26,31)(H,27,32)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236234
PNG
(US9365575, 12)
Show SMILES COc1ccc(NC(=O)Nc2ccc(cc2)C2CN=C3N(C2)C(=O)Nc2ccccc32)cc1
Show InChI InChI=1S/C25H23N5O3/c1-33-20-12-10-19(11-13-20)28-24(31)27-18-8-6-16(7-9-18)17-14-26-23-21-4-2-3-5-22(21)29-25(32)30(23)15-17/h2-13,17H,14-15H2,1H3,(H,29,32)(H2,27,28,31)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236236
PNG
(US9365575, 14)
Show SMILES CC(C)NC(=O)Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C21H23N5O2/c1-13(2)23-20(27)24-16-9-7-14(8-10-16)15-11-22-19-17-5-3-4-6-18(17)25-21(28)26(19)12-15/h3-10,13,15H,11-12H2,1-2H3,(H,25,28)(H2,23,24,27)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236244
PNG
(US9365575, 22)
Show SMILES Cc1cc(ccc1N)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C18H18N4O/c1-11-8-12(6-7-15(11)19)13-9-20-17-14-4-2-3-5-16(14)21-18(23)22(17)10-13/h2-8,13H,9-10,19H2,1H3,(H,21,23)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236238
PNG
(US9365575, 16)
Show SMILES Cc1ccoc1C(=O)Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C23H20N4O3/c1-14-10-11-30-20(14)22(28)25-17-8-6-15(7-9-17)16-12-24-21-18-4-2-3-5-19(18)26-23(29)27(21)13-16/h2-11,16H,12-13H2,1H3,(H,25,28)(H,26,29)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236241
PNG
(US9365575, 19)
Show SMILES COC(=O)c1ccc2C3=NCC(CN3C(=O)Nc2c1)c1ccc(cc1)N(C)C(=O)CN1CCN(C)CC1
Show InChI InChI=1S/C27H32N6O4/c1-30-10-12-32(13-11-30)17-24(34)31(2)21-7-4-18(5-8-21)20-15-28-25-22-9-6-19(26(35)37-3)14-23(22)29-27(36)33(25)16-20/h4-9,14,20H,10-13,15-17H2,1-3H3,(H,29,36)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236245
PNG
(US9365575, 23)
Show SMILES Cc1cc(N)ccc1C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C18H18N4O/c1-11-8-13(19)6-7-14(11)12-9-20-17-15-4-2-3-5-16(15)21-18(23)22(17)10-12/h2-8,12H,9-10,19H2,1H3,(H,21,23)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236239
PNG
(US9365575, 17)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C25H19F3N4O2/c26-25(27,28)18-5-3-4-16(12-18)23(33)30-19-10-8-15(9-11-19)17-13-29-22-20-6-1-2-7-21(20)31-24(34)32(22)14-17/h1-12,17H,13-14H2,(H,30,33)(H,31,34)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236240
PNG
(US9365575, 18)
Show SMILES CNc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1cc(ccc21)C(=O)OC
Show InChI InChI=1S/C20H20N4O3/c1-21-15-6-3-12(4-7-15)14-10-22-18-16-8-5-13(19(25)27-2)9-17(16)23-20(26)24(18)11-14/h3-9,14,21H,10-11H2,1-2H3,(H,23,26)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


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Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236223
PNG
(US9365575, 1)
Show SMILES Clc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C17H14ClN3O/c18-13-7-5-11(6-8-13)12-9-19-16-14-3-1-2-4-15(14)20-17(22)21(16)10-12/h1-8,12H,9-10H2,(H,20,22)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236226
PNG
(US9365575, 4)
Show SMILES Nc1ccc(cc1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C17H16N4O/c18-13-7-5-11(6-8-13)12-9-19-16-14-3-1-2-4-15(14)20-17(22)21(16)10-12/h1-8,12H,9-10,18H2,(H,20,22)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236243
PNG
(US9365575, 21)
Show SMILES COC(=O)c1ccc2C3=NCC(CN3C(=O)Nc2c1)c1ccc(cc1)N(C)C(=O)Nc1cc(ccc1F)C(F)(F)F
Show InChI InChI=1S/C28H23F4N5O4/c1-36(26(39)35-23-12-18(28(30,31)32)6-10-21(23)29)19-7-3-15(4-8-19)17-13-33-24-20-9-5-16(25(38)41-2)11-22(20)34-27(40)37(24)14-17/h3-12,17H,13-14H2,1-2H3,(H,34,40)(H,35,39)
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Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


Citation and Details
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM236224
PNG
(US9365575, 2)
Show SMILES Nc1cccc(c1)C1CN=C2N(C1)C(=O)Nc1ccccc21
Show InChI InChI=1S/C17H16N4O/c18-13-5-3-4-11(8-13)12-9-19-16-14-6-1-2-7-15(14)20-17(22)21(16)10-12/h1-8,12H,9-10,18H2,(H,20,22)
PDB
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n/an/a>1.00E+4n/an/an/an/an/an/a



Allergan, Inc.

US Patent


Assay Description
Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:1) in 10 m...


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