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BDBM50002442 CHEMBL2113178

SMILES: COCCOc1cc2ncnc(NC3=CC(=O)C=CC3=O)c2cc1OC

InChI Key: InChIKey=QGHREIIGQGMVTP-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50002442   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50002442
PNG
(CHEMBL2113178)
Show SMILES COCCOc1cc2ncnc(NC3=CC(=O)C=CC3=O)c2cc1OC |c:17,t:13|
Show InChI InChI=1S/C18H17N3O5/c1-24-5-6-26-17-9-13-12(8-16(17)25-2)18(20-10-19-13)21-14-7-11(22)3-4-15(14)23/h3-4,7-10H,5-6H2,1-2H3,(H,19,20,21)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
n/an/a>1.00E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory activity against VEGF stimulated autophosphorylation of VEGFR2 expressed in KDR15 cells


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50002442
PNG
(CHEMBL2113178)
Show SMILES COCCOc1cc2ncnc(NC3=CC(=O)C=CC3=O)c2cc1OC |c:17,t:13|
Show InChI InChI=1S/C18H17N3O5/c1-24-5-6-26-17-9-13-12(8-16(17)25-2)18(20-10-19-13)21-14-7-11(22)3-4-15(14)23/h3-4,7-10H,5-6H2,1-2H3,(H,19,20,21)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Patents

Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
More data for this
Ligand-Target Pair