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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Vascular endothelial growth factor receptor 2' and Ligand = 'BDBM365312'   
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))
BDBM365312
PNG
(US10633373, Example 31 | US10669265, Example 31 | ...)
Show SMILES Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B(O)O)c1
Show InChI InChI=1S/C21H19BN4O3S/c1-12-3-2-4-15(7-12)25-21(27)26-16-5-6-18-13(8-16)9-19(30-18)17-10-14(22(28)29)11-24-20(17)23/h2-11,28-29H,1H3,(H2,23,24)(H2,25,26,27)
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PC cid
PC sid
UniChem
US Patent
n/an/a 42n/an/an/an/an/an/a



Amgen



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...


J Med Chem 50: 3515-27 (2007)


BindingDB Entry DOI: 10.7270/Q2DB8465
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM365312
PNG
(US10633373, Example 31 | US10669265, Example 31 | ...)
Show SMILES Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B(O)O)c1
Show InChI InChI=1S/C21H19BN4O3S/c1-12-3-2-4-15(7-12)25-21(27)26-16-5-6-18-13(8-16)9-19(30-18)17-10-14(22(28)29)11-24-20(17)23/h2-11,28-29H,1H3,(H2,23,24)(H2,25,26,27)
PDB
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PC cid
PC sid
UniChem
US Patent
n/an/a 93n/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...


US Patent US10669265 (2020)


BindingDB Entry DOI: 10.7270/Q20R9SFZ
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM365312
PNG
(US10633373, Example 31 | US10669265, Example 31 | ...)
Show SMILES Cc1cccc(NC(=O)Nc2ccc3sc(cc3c2)-c2cc(cnc2N)B(O)O)c1
Show InChI InChI=1S/C21H19BN4O3S/c1-12-3-2-4-15(7-12)25-21(27)26-16-5-6-18-13(8-16)9-19(30-18)17-10-14(22(28)29)11-24-20(17)23/h2-11,28-29H,1H3,(H2,23,24)(H2,25,26,27)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 93n/an/an/an/an/an/a



Allergan, Inc.

US Patent


Assay Description
VEGFR2: Biochemical KDR kinase assays were performed in 96 well microtiter plates that were coated overnight with 75 μg/well of poly-Glu-Tyr (4:...


US Patent US10633373 (2020)


BindingDB Entry DOI: 10.7270/Q2Z60S37
More data for this
Ligand-Target Pair