Brief Information of the Compound and Protein
Compound Name
2-(4-{[(3-Iodophenyl)amino]carbonothioyl}-1-piperazinyl)-8-ethyl-5-oxo-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic Acid
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PubChem ID
CID: 45484138
SID: 96032654
Canonical SMILES
CCn1cc(C(O)=O)c(=O)c2cnc(nc12)N1CCN(CC1)C(=S)Nc1cccc(I)c1
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Compound Formula C21H21IN6O3S
Compound Structure
Protein Name
Ectonucleotide pyrophosphatase/phosphodiesterase family member 2
Protein Classification
Enzyme
Uniprot ID
Q13822
Gene Name
ENPP2
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)  3
1
IC50 = 1600 nM
   TI
   LI
   LO
   TS
2
Ki = 7400 nM
   TI
   LI
   LO
   TS
3
Ki = 11000 nM
   TI
   LI
   LO
   TS