Brief Information of the Compound and Protein
Compound Name
N-(6-fluoro-1-oxo-2H-isoquinolin-7-yl)-5-[(3R)-3-hydroxypyrrolidin-1-yl]thiophene-2-sulfonamide
    Show/Hide
PubChem ID
CID: 121378588
Canonical SMILES
O[C@@H]1CCN(C1)c1ccc(s1)S(=O)(=O)Nc1cc2c(cc[nH]c2=O)cc1F
    Show/Hide
Compound Formula C17H16FN3O4S2
Compound Structure
Protein Name
Bifunctional purine biosynthesis protein ATIC
Protein Classification
Enzyme
Uniprot ID
P31939
Gene Name
ATIC
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000111 MDA-MB-231 Homo sapiens (Human)  2
1
EC50 = 7.6 nM
   TI
   LI
   LO
   TS
2
EC50 = 73 nM
   TI
   LI
   LO
   TS
CL000145 NCI-H460 Homo sapiens (Human)  2
1
EC50 = 8 nM
   TI
   LI
   LO
   TS
2
EC50 = 356 nM
   TI
   LI
   LO
   TS