Brief Information of the Compound and Protein
Compound Name
AG-013736
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PubChem ID
CID: 6450551
SID: 26683791
Canonical SMILES
CNC(=O)c1ccccc1Sc1ccc2c(\C=C\c3ccccn3)n[nH]c2c1
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Compound Formula C22H18N4OS
Compound Structure
Protein Name
Mast/stem cell growth factor receptor Kit
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase PDGFR family
Uniprot ID
P10721
Gene Name
KIT
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000077 Ba/F3 Mus musculus (Mouse)  14
1
GI50 = 2 nM
   TI
   LI
   LO
   TS
2
GI50 = 5 nM
   TI
   LI
   LO
   TS
3
GI50 = 7 nM
   TI
   LI
   LO
   TS
4
GI50 = 12 nM
   TI
   LI
   LO
   TS
5
GI50 = 13 nM
   TI
   LI
   LO
   TS
6
GI50 = 14 nM
   TI
   LI
   LO
   TS
7
GI50 = 105 nM
   TI
   LI
   LO
   TS
8
GI50 = 108 nM
   TI
   LI
   LO
   TS
9
GI50 = 129 nM
   TI
   LI
   LO
   TS
10
GI50 = 156 nM
   TI
   LI
   LO
   TS
11
GI50 = 406 nM
   TI
   LI
   LO
   TS
12
GI50 = 1720 nM
   TI
   LI
   LO
   TS
13
GI50 = 1820 nM
   TI
   LI
   LO
   TS
14
GI50 = 2020 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 Kd = 0.49 nM
2 Kd = 1.4 nM
3 Kd = 1.7 nM
4 Kd = 3.2 nM
5 Kd = 3.5 nM
6 Kd = 3.7 nM
7 Kd = 13 nM
8 Kd = 1300 nM
9 Kd = 1800 nM
10 Kd = 4200 nM