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BDBM50428367 CHEMBL2332119::Vegfrecine

SMILES: NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O

InChI Key: InChIKey=PAYLFJFRBIHGBV-UHFFFAOYSA-N

Data: 6 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50428367   
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
Epidermal growth factor receptor


(Homo sapiens (human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of EGFR (unknown origin) after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 480n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PDGFR-beta (unknown origin) after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor


(Homo sapiens (human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 18n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of GST-Flt1 kinase domain (unknown origin) expressed in baculovirus infected Sf9 cells after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Flt4 (unknown origin) after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of KDR (unknown origin) after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor


(Homo sapiens (Human))
BDBM50428367
PNG
(CHEMBL2332119 | Vegfrecine)
Show SMILES NC(=O)C1=C(N)C(=O)C=C(Nc2ccccc2O)C1=O
Show InChI InChI=1S/C13H11N3O4/c14-11-9(18)5-7(12(19)10(11)13(15)20)16-6-3-1-2-4-8(6)17/h1-5,16-17H,14H2,(H2,15,20)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.20E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of PDGFR-alpha (unknown origin) after 20 mins by scintillation counting


Citation and Details

Article DOI: 10.1021/np300535c
BindingDB Entry DOI: 10.7270/Q2JQ12BH
More data for this
Ligand-Target Pair