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BDBM50525510 CHEMBL4574832

SMILES: OC(=O)c1ccc(Nc2ccnc(SCC(=O)c3ccc(Cl)cc3)n2)cc1

InChI Key: InChIKey=LFBGEWWFVHQYKC-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   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 = 50525510   
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))
BDBM50525510
PNG
(CHEMBL4574832)
Show SMILES OC(=O)c1ccc(Nc2ccnc(SCC(=O)c3ccc(Cl)cc3)n2)cc1
Show InChI InChI=1S/C19H14ClN3O3S/c20-14-5-1-12(2-6-14)16(24)11-27-19-21-10-9-17(23-19)22-15-7-3-13(4-8-15)18(25)26/h1-10H,11H2,(H,25,26)(H,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 170n/an/an/an/an/an/a



National Research Centre

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST tagged VEGFR-2 expressed in baculovirus infected Sf9 cells using poly (Glu,Tyr) 4:1 as substrate in presence of AT...


Eur J Med Chem 179: 707-722 (2019)


Article DOI: 10.1016/j.ejmech.2019.06.063
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase B-raf


(Homo sapiens (Human))
BDBM50525510
PNG
(CHEMBL4574832)
Show SMILES OC(=O)c1ccc(Nc2ccnc(SCC(=O)c3ccc(Cl)cc3)n2)cc1
Show InChI InChI=1S/C19H14ClN3O3S/c20-14-5-1-12(2-6-14)16(24)11-27-19-21-10-9-17(23-19)22-15-7-3-13(4-8-15)18(25)26/h1-10H,11H2,(H,25,26)(H,21,22,23)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 370n/an/an/an/an/an/a



National Research Centre

Curated by ChEMBL


Assay Description
Inhibition of human wild type BRAF by Kinase-Glo luminescence assay


Eur J Med Chem 179: 707-722 (2019)


Article DOI: 10.1016/j.ejmech.2019.06.063
More data for this
Ligand-Target Pair