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BDBM50020170 CHEMBL3288502::US9914707, I-1

SMILES: Nc1n[nH]c2cccc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12

InChI Key: InChIKey=IEKZIHNUIYVYMJ-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50020170   
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))
BDBM50020170
PNG
(CHEMBL3288502 | US9914707, I-1)
Show SMILES Nc1n[nH]c2cccc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12
Show InChI InChI=1S/C24H18N4O/c25-23-22-19(9-5-11-21(22)27-28-23)16-12-13-18-15(14-16)6-4-10-20(18)24(29)26-17-7-2-1-3-8-17/h1-14H,(H,26,29)(H3,25,27,28)
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Article
PubMed
n/an/a 1.60n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of VEGFR-2 (unknown origin) expressed in baculovirus expression system using poly (4 Glu, Tyr) as substrate after 60 mins by ELISA


ACS Med Chem Lett 5: 592-7 (2014)


Article DOI: 10.1021/ml5000417
BindingDB Entry DOI: 10.7270/Q2TB18GG
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50020170
PNG
(CHEMBL3288502 | US9914707, I-1)
Show SMILES Nc1n[nH]c2cccc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12
Show InChI InChI=1S/C24H18N4O/c25-23-22-19(9-5-11-21(22)27-28-23)16-12-13-18-15(14-16)6-4-10-20(18)24(29)26-17-7-2-1-3-8-17/h1-14H,(H,26,29)(H3,25,27,28)
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US Patent
n/an/a 1.60n/an/an/an/an/an/a



Schering-Plough Research Institute



Assay Description
The enzyme reaction substrate Poly(Glu, Tyr)4:1 was diluted with potassium-free PBS (10 mM sodium phosphate buffer, 150 mM NaCl, pH 7.2-7.4) to 20 &#...


J Med Chem 51: 725-36 (2008)


BindingDB Entry DOI: 10.7270/Q2DR2XS5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50020170
PNG
(CHEMBL3288502 | US9914707, I-1)
Show SMILES Nc1n[nH]c2cccc(-c3ccc4c(cccc4c3)C(=O)Nc3ccccc3)c12
Show InChI InChI=1S/C24H18N4O/c25-23-22-19(9-5-11-21(22)27-28-23)16-12-13-18-15(14-16)6-4-10-20(18)24(29)26-17-7-2-1-3-8-17/h1-14H,(H,26,29)(H3,25,27,28)
PDB
MMDB

NCI pathway
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KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 3.80n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of VEGFR-2 in HUVEC assessed as inhibition of VEGF (1 to 165)-induced cell proliferation preincubated for 2 hrs followed by VEGF (1 to 165...


ACS Med Chem Lett 5: 592-7 (2014)


Article DOI: 10.1021/ml5000417
BindingDB Entry DOI: 10.7270/Q2TB18GG
More data for this
Ligand-Target Pair