Brief Information of the Compound and Protein
Compound Name
5-[3-methoxy-3-(3,4,5-trimethoxyphenyl)prop-1-yn-1-yl]-6-methylpyrimidine-2,4-diamine
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PubChem ID
CID: 16110341
SID: 24757169
Canonical SMILES
COC(C#Cc1c(C)nc(N)nc1N)c1cc(OC)c(OC)c(OC)c1
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Compound Formula C18H22N4O4
Compound Structure
Protein Name
Dihydrofolate reductase
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
Q81R22
Gene Name
DFRA
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000338 DV3-M15 Mus musculus (Mouse)  1
1
IC50 = 29100 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 29100 nM
2 Ki = 9810 nM