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BDBM50118504 1-(4-Benzyloxy-but-2-enyl)-5-methyl-1H-pyrimidine-2,4-dione::CHEMBL132921

SMILES: Cc1cn(C\C=C/COCc2ccccc2)c(=O)[nH]c1=O

InChI Key: InChIKey=UWVHGIHVWKAXQU-WAYWQWQTSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50118504   
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
Thymidine kinase, cytosolic


(Homo sapiens (Human))
BDBM50118504
PNG
(1-(4-Benzyloxy-but-2-enyl)-5-methyl-1H-pyrimidine-...)
Show SMILES Cc1cn(C\C=C/COCc2ccccc2)c(=O)[nH]c1=O
Show InChI InChI=1S/C16H18N2O3/c1-13-11-18(16(20)17-15(13)19)9-5-6-10-21-12-14-7-3-2-4-8-14/h2-8,11H,9-10,12H2,1H3,(H,17,19,20)/b6-5-
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.20E+4n/an/an/an/an/an/a



Instituto de Qu£mica M£dica (CSIC)

Curated by ChEMBL


Assay Description
Inhibitory effect against phosphorylation of [methyl-3H]dThd by Thymidine Kinase 2 (TK-2)


J Med Chem 45: 4254-63 (2002)


BindingDB Entry DOI: 10.7270/Q2GQ6ZGB
More data for this
Ligand-Target Pair