Brief Information of the Compound and Protein
Compound Name
 Compound Info 
2-[(2-butan-2-yl-3-oxo-2H-imidazo[1,2-c]quinazolin-5-yl)sulfanyl]-N-(2-methylphenyl)butanamide
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 PubChem ID
CID: 20965633
Canonical SMILES
CCC(C)C1N=C2N(C1=O)C(SC(CC)C(=O)Nc1ccccc1C)=Nc1ccccc21
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Compound Formula C25H28N4O2S
Compound Structure
Protein Name
 Protein Info 
Aldehyde dehydrogenase 1A1
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
P00352
Gene Name
ALDH1A1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000207 MIA PaCa-2
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 1010 nM
   TI
   LI
   LO
   TS
CL000849 OV-90
 Cell Line Info 
Homo sapiens (Human)  2
1
EC50 > 50000 nM
   TI
   LI
   LO
   TS
2
EC50 > 5000 nM
   TI
   LI
   LO
   TS
CL000848 SKOV3/TR
 Cell Line Info 
Homo sapiens (Human)  1
1
EC50 = 2220 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 119 nM
2 IC50 = 390 nM