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BDBM50366088 CHEMBL1956888

SMILES: Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1

InChI Key: InChIKey=ODNOXDGDVDWXGJ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50366088   
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))
BDBM50366088
PNG
(CHEMBL1956888)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1
Show InChI InChI=1S/C19H16BrN5/c20-14-7-4-8-15(11-14)22-17-16-9-10-25(18(16)24-19(21)23-17)12-13-5-2-1-3-6-13/h1-11H,12H2,(H3,21,22,23,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.66E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGF-induced EGFR autophosphorylation in human A431 cells incubated for 60 mins prior to EGF-induction measured after 10 mins by phospho...


Bioorg Med Chem 20: 2444-54 (2012)


Article DOI: 10.1016/j.bmc.2012.01.029
BindingDB Entry DOI: 10.7270/Q2XK8G14
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50366088
PNG
(CHEMBL1956888)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1
Show InChI InChI=1S/C19H16BrN5/c20-14-7-4-8-15(11-14)22-17-16-9-10-25(18(16)24-19(21)23-17)12-13-5-2-1-3-6-13/h1-11H,12H2,(H3,21,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFBB-induced PDGFRbeta autophosphorylation in human SF539 cells incubated for 60 mins prior to PDGFBB-induction measured after 10 min...


Bioorg Med Chem 20: 2444-54 (2012)


Article DOI: 10.1016/j.bmc.2012.01.029
BindingDB Entry DOI: 10.7270/Q2XK8G14
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50366088
PNG
(CHEMBL1956888)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1
Show InChI InChI=1S/C19H16BrN5/c20-14-7-4-8-15(11-14)22-17-16-9-10-25(18(16)24-19(21)23-17)12-13-5-2-1-3-6-13/h1-11H,12H2,(H3,21,22,23,24)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.38E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced VEGFR2 autophosphorylation in human U251 cells incubated for 60 mins prior to VEGF-induction measured after 10 mins by pho...


Bioorg Med Chem 20: 2444-54 (2012)


Article DOI: 10.1016/j.bmc.2012.01.029
BindingDB Entry DOI: 10.7270/Q2XK8G14
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50366088
PNG
(CHEMBL1956888)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2ccn(Cc3ccccc3)c2n1
Show InChI InChI=1S/C19H16BrN5/c20-14-7-4-8-15(11-14)22-17-16-9-10-25(18(16)24-19(21)23-17)12-13-5-2-1-3-6-13/h1-11H,12H2,(H3,21,22,23,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 9.93E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced VEGFR1 autophosphorylation in human A498 cells incubated for 60 mins prior to VEGF-induction measured after 10 mins by pho...


Bioorg Med Chem 20: 2444-54 (2012)


Article DOI: 10.1016/j.bmc.2012.01.029
BindingDB Entry DOI: 10.7270/Q2XK8G14
More data for this
Ligand-Target Pair