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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Vascular endothelial growth factor receptor 2' and Ligand = 'BDBM110598'   
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))
BDBM110598
PNG
(US8614234, 66 | US9725433, 66)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(Oc3ccnc(c3)-c3cc(c[nH]3)C(=O)NCCCC(O)=O)cc2F)c1
Show InChI InChI=1S/C28H25F2N5O5/c1-16-4-6-20(29)23(11-16)35-28(39)34-22-7-5-18(13-21(22)30)40-19-8-10-31-25(14-19)24-12-17(15-33-24)27(38)32-9-2-3-26(36)37/h4-8,10-15,33H,2-3,9H2,1H3,(H,32,38)(H,36,37)(H2,34,35,39)
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MMDB

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PC cid
PC sid
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Similars

US Patent
n/an/a 17n/an/an/an/an/an/a



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...


US Patent US9725433 (2017)


BindingDB Entry DOI: 10.7270/Q2ZP4875
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM110598
PNG
(US8614234, 66 | US9725433, 66)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(Oc3ccnc(c3)-c3cc(c[nH]3)C(=O)NCCCC(O)=O)cc2F)c1
Show InChI InChI=1S/C28H25F2N5O5/c1-16-4-6-20(29)23(11-16)35-28(39)34-22-7-5-18(13-21(22)30)40-19-8-10-31-25(14-19)24-12-17(15-33-24)27(38)32-9-2-3-26(36)37/h4-8,10-15,33H,2-3,9H2,1H3,(H,32,38)(H,36,37)(H2,34,35,39)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 17n/an/an/an/a7.225



Allergan, Inc.

US Patent


Assay Description
Kinase assays were performed in 96 well microtiter plates that were coated overnight with 30.mu.g of poly-Glu-Tyr (4:1) in 10 mM Phosphate Buffered S...


US Patent US8614234 (2013)


BindingDB Entry DOI: 10.7270/Q20Z71XF
More data for this
Ligand-Target Pair