Brief Information of the Compound and Protein
Compound Name
2-[(2S)-2,3-dihydroxypropyl]-8-(2-fluoro-4-iodoanilino)pyrido[3,4-d]pyridazin-1-one
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PubChem ID
CID: 86294748
Canonical SMILES
OC[C@@H](O)Cn1ncc2cncc(Nc3ccc(I)cc3F)c2c1=O
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Compound Formula C16H14FIN4O3
Compound Structure
Protein Name
Dual specificity mitogen-activated protein kinase kinase 1
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
STE protein kinase group
>
STE protein kinase STE7 family
Uniprot ID
Q02750
Gene Name
MAP2K1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000068 A-549 Homo sapiens (Human)  1
1
IC50 = 58 nM
   TI
   LI
   LO
   TS
CL000163 COLO 205 Homo sapiens (Human)  1
1
IC50 = 1.95 nM
   TI
   LI
   LO
   TS
CL000067 HCT 116 Homo sapiens (Human)  1
1
IC50 = 35.5 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 1.63 nM