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Patent code US9388181

Compile Data Set for Download or QSAR
Found 15 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))
BDBM236912
PNG
(US9388181, 4)
Show SMILES FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-2-5-18(12-17)29-22(32)15-3-1-6-19(11-15)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,29,32)
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US Patent
n/an/a 6n/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))
BDBM236916
PNG
(US9388181, 11)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-1-3-15(11-17)22(32)29-18-5-2-6-19(12-18)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,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))
BDBM236911
PNG
(US9388181, 3)
Show SMILES CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C25H25N5O/c1-17(2)18-5-3-7-21(13-18)28-25(31)19-6-4-8-22(14-19)29-12-10-23-20(16-29)15-26-24-9-11-27-30(23)24/h3-9,11,13-15,17H,10,12,16H2,1-2H3,(H,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
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236911
PNG
(US9388181, 3)
Show SMILES CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C25H25N5O/c1-17(2)18-5-3-7-21(13-18)28-25(31)19-6-4-8-22(14-19)29-12-10-23-20(16-29)15-26-24-9-11-27-30(23)24/h3-9,11,13-15,17H,10,12,16H2,1-2H3,(H,28,31)
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Allergan, Inc.

US Patent


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


Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236916
PNG
(US9388181, 11)
Show SMILES FC(F)(F)c1cccc(c1)C(=O)Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-1-3-15(11-17)22(32)29-18-5-2-6-19(12-18)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,29,32)
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Allergan, Inc.

US Patent


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


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


(Homo sapiens (human))
BDBM236911
PNG
(US9388181, 3)
Show SMILES CC(C)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C25H25N5O/c1-17(2)18-5-3-7-21(13-18)28-25(31)19-6-4-8-22(14-19)29-12-10-23-20(16-29)15-26-24-9-11-27-30(23)24/h3-9,11,13-15,17H,10,12,16H2,1-2H3,(H,28,31)
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Allergan, Inc.

US Patent


Assay Description
Automated FLIPR (Fluorometric Imaging Plate Reader) technology was used to screen for inhibitors of VEGF induced increases in intracellular calcium l...


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


(Homo sapiens (human))
BDBM236917
PNG
(US9388181, 12)
Show SMILES Cc1cccc(NC(=O)Nc2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H22N6O/c1-16-4-2-5-18(12-16)26-23(30)27-19-6-3-7-20(13-19)28-11-9-21-17(15-28)14-24-22-8-10-25-29(21)22/h2-8,10,12-14H,9,11,15H2,1H3,(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
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236912
PNG
(US9388181, 4)
Show SMILES FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-2-5-18(12-17)29-22(32)15-3-1-6-19(11-15)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,29,32)
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Allergan, Inc.

US Patent


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


Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236917
PNG
(US9388181, 12)
Show SMILES Cc1cccc(NC(=O)Nc2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H22N6O/c1-16-4-2-5-18(12-16)26-23(30)27-19-6-3-7-20(13-19)28-11-9-21-17(15-28)14-24-22-8-10-25-29(21)22/h2-8,10,12-14H,9,11,15H2,1H3,(H2,26,27,30)
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Allergan, Inc.

US Patent


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


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


(Homo sapiens (human))
BDBM236912
PNG
(US9388181, 4)
Show SMILES FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-2-5-18(12-17)29-22(32)15-3-1-6-19(11-15)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,29,32)
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Allergan, Inc.

US Patent


Assay Description
Automated FLIPR (Fluorometric Imaging Plate Reader) technology was used to screen for inhibitors of VEGF induced increases in intracellular calcium l...


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


(Homo sapiens (human))
BDBM236915
PNG
(US9388181, 10)
Show SMILES O=C(Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21)c1ccccc1
Show InChI InChI=1S/C22H19N5O/c28-22(16-5-2-1-3-6-16)25-18-7-4-8-19(13-18)26-12-10-20-17(15-26)14-23-21-9-11-24-27(20)21/h1-9,11,13-14H,10,12,15H2,(H,25,28)
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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
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236912
PNG
(US9388181, 4)
Show SMILES FC(F)(F)c1cccc(NC(=O)c2cccc(c2)N2CCc3c(C2)cnc2ccnn32)c1
Show InChI InChI=1S/C23H18F3N5O/c24-23(25,26)17-4-2-5-18(12-17)29-22(32)15-3-1-6-19(11-15)30-10-8-20-16(14-30)13-27-21-7-9-28-31(20)21/h1-7,9,11-13H,8,10,14H2,(H,29,32)
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Allergan, Inc.

US Patent


Assay Description
Automated FLIPR (Fluorometric Imaging Plate Reader) technology was used to screen for inhibitors of PDGF-induced increases in intracellular calcium l...


Citation and Details
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM236915
PNG
(US9388181, 10)
Show SMILES O=C(Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21)c1ccccc1
Show InChI InChI=1S/C22H19N5O/c28-22(16-5-2-1-3-6-16)25-18-7-4-8-19(13-18)26-12-10-20-17(15-26)14-23-21-9-11-24-27(20)21/h1-9,11,13-14H,10,12,15H2,(H,25,28)
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Allergan, Inc.

US Patent


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


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


(Homo sapiens (human))
BDBM236914
PNG
(US9388181, 8)
Show SMILES CC(C)(C)OC(=O)Nc1cccc(c1)N1CCc2c(C1)cnc1ccnn21
Show InChI InChI=1S/C20H23N5O2/c1-20(2,3)27-19(26)23-15-5-4-6-16(11-15)24-10-8-17-14(13-24)12-21-18-7-9-22-25(17)18/h4-7,9,11-12H,8,10,13H2,1-3H3,(H,23,26)
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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))
BDBM236913
PNG
(US9388181, 7)
Show SMILES CC(C)c1cccc(NC(=O)c2cccc(c2)N2Cc3cnc4ccnn4c3C2)c1
Show InChI InChI=1S/C24H23N5O/c1-16(2)17-5-3-7-20(11-17)27-24(30)18-6-4-8-21(12-18)28-14-19-13-25-23-9-10-26-29(23)22(19)15-28/h3-13,16H,14-15H2,1-2H3,(H,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
* indicates data uncertainty>20%