BindingDB logo
myBDB logout

Patent code US9321721

Compile Data Set for Download or QSAR
Found 8 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))
BDBM223055
PNG
(US9321721, Example 3)
Show SMILES COc1ccc(cc1)C(=C\C(N)=O)\c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C24H19F4N3O3/c1-34-18-9-4-15(5-10-18)19(13-22(29)32)14-2-7-17(8-3-14)30-23(33)31-21-12-16(24(26,27)28)6-11-20(21)25/h2-13H,1H3,(H2,29,32)(H2,30,31,33)/b19-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 457n/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))
BDBM223053
PNG
(US9321721, Example 1)
Show SMILES NC(=O)\C=C(\c1ccccc1)c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C23H17F4N3O2/c24-19-11-8-16(23(25,26)27)12-20(19)30-22(32)29-17-9-6-15(7-10-17)18(13-21(28)31)14-4-2-1-3-5-14/h1-13H,(H2,28,31)(H2,29,30,32)/b18-13-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 626n/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))
BDBM223054
PNG
(US9321721, Example 2)
Show SMILES COc1cccc(c1)C(=C\C(N)=O)\c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C24H19F4N3O3/c1-34-18-4-2-3-15(11-18)19(13-22(29)32)14-5-8-17(9-6-14)30-23(33)31-21-12-16(24(26,27)28)7-10-20(21)25/h2-13H,1H3,(H2,29,32)(H2,30,31,33)/b19-13+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 945n/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))
BDBM223059
PNG
(US9321721, Example 7)
Show SMILES NC(=O)\C=C/c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C17H13F4N3O2/c18-13-7-4-11(17(19,20)21)9-14(13)24-16(26)23-12-5-1-10(2-6-12)3-8-15(22)25/h1-9H,(H2,22,25)(H2,23,24,26)/b8-3-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.79E+3n/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))
BDBM223057
PNG
(US9321721, Example 5 | US9321721, Example 8)
Show SMILES NC(=O)\C=C\c1cccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)c1
Show InChI InChI=1S/C17H13F4N3O2/c18-13-6-5-11(17(19,20)21)9-14(13)24-16(26)23-12-3-1-2-10(8-12)4-7-15(22)25/h1-9H,(H2,22,25)(H2,23,24,26)/b7-4+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM223056
PNG
(US9321721, Example 4)
Show SMILES NC(=O)\C=C(\c1ccccc1)c1cccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)c1
Show InChI InChI=1S/C23H17F4N3O2/c24-19-10-9-16(23(25,26)27)12-20(19)30-22(32)29-17-8-4-7-15(11-17)18(13-21(28)31)14-5-2-1-3-6-14/h1-13H,(H2,28,31)(H2,29,30,32)/b18-13-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM223058
PNG
(US9321721, Example 6)
Show SMILES NC(=O)\C=C\c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C17H13F4N3O2/c18-13-7-4-11(17(19,20)21)9-14(13)24-16(26)23-12-5-1-10(2-6-12)3-8-15(22)25/h1-9H,(H2,22,25)(H2,23,24,26)/b8-3+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
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
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM223057
PNG
(US9321721, Example 5 | US9321721, Example 8)
Show SMILES NC(=O)\C=C\c1cccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)c1
Show InChI InChI=1S/C17H13F4N3O2/c18-13-6-5-11(17(19,20)21)9-14(13)24-16(26)23-12-3-1-2-10(8-12)4-7-15(22)25/h1-9H,(H2,22,25)(H2,23,24,26)/b7-4+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
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%