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BDBM50115318 3-{[4-(6,7-Dimethoxy-quinazolin-4-yl)-piperazine-1-carbothioyl]-amino}-benzoic acid::CHEMBL104924

SMILES: COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3cccc(c3)C(O)=O)c2cc1OC

InChI Key: InChIKey=FHWIMRLSJGLGFL-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50115318   
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
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50115318
PNG
(3-{[4-(6,7-Dimethoxy-quinazolin-4-yl)-piperazine-1...)
Show SMILES COc1cc2ncnc(N3CCN(CC3)C(=S)Nc3cccc(c3)C(O)=O)c2cc1OC
Show InChI InChI=1S/C22H23N5O4S/c1-30-18-11-16-17(12-19(18)31-2)23-13-24-20(16)26-6-8-27(9-7-26)22(32)25-15-5-3-4-14(10-15)21(28)29/h3-5,10-13H,6-9H2,1-2H3,(H,25,32)(H,28,29)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents

PubMed
n/an/a>3.00E+4n/an/an/an/an/an/a



Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Platelet-derived growth factor receptor beta phosphorylation


J Med Chem 45: 3057-66 (2002)


BindingDB Entry DOI: 10.7270/Q2RX9BDP
More data for this
Ligand-Target Pair