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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 = 'BDBM365366'   
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))
BDBM365366
PNG
(US10633373, Example 71 | US10669265, Example 71 | ...)
Show SMILES COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
Show InChI InChI=1S/C32H38FN5O7S/c1-21-10-15-26(33)27(18-21)37-32(42)36-24-13-11-22(12-14-24)25-19-23(20-35-30(25)34)31(41)38-46(43,16-6-4-8-28(39)44-2)17-7-5-9-29(40)45-3/h10-15,18-20H,4-9,16-17H2,1-3H3,(H2,34,35)(H2,36,37,42)
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PC cid
PC sid
UniChem
US Patent
n/an/a 33n/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
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM365366
PNG
(US10633373, Example 71 | US10669265, Example 71 | ...)
Show SMILES COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
Show InChI InChI=1S/C32H38FN5O7S/c1-21-10-15-26(33)27(18-21)37-32(42)36-24-13-11-22(12-14-24)25-19-23(20-35-30(25)34)31(41)38-46(43,16-6-4-8-28(39)44-2)17-7-5-9-29(40)45-3/h10-15,18-20H,4-9,16-17H2,1-3H3,(H2,34,35)(H2,36,37,42)
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PC cid
PC sid
UniChem
US Patent
n/an/a 33n/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))
BDBM365366
PNG
(US10633373, Example 71 | US10669265, Example 71 | ...)
Show SMILES COC(=O)CCCCS(=O)(CCCCC(=O)OC)=NC(=O)c1cnc(N)c(c1)-c1ccc(NC(=O)Nc2cc(C)ccc2F)cc1
Show InChI InChI=1S/C32H38FN5O7S/c1-21-10-15-26(33)27(18-21)37-32(42)36-24-13-11-22(12-14-24)25-19-23(20-35-30(25)34)31(41)38-46(43,16-6-4-8-28(39)44-2)17-7-5-9-29(40)45-3/h10-15,18-20H,4-9,16-17H2,1-3H3,(H2,34,35)(H2,36,37,42)
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
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antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 88n/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