Brief Information of the Compound and Protein
Compound Name
(S)-2-amino-3-(1-methyl-1H-indol-3-yl)propanoic acid
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PubChem ID
CID: 6920150
SID: 24714968
Canonical SMILES
Cn1cc(C[C@H](N)C(O)=O)c2ccccc12
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Compound Formula C12H14N2O2
Compound Structure
Protein Name
Indoleamine 2,3-dioxygenase 1
Protein Classification
Enzyme
>
Oxidoreductase
Uniprot ID
P14902
Gene Name
IDO1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000006 HEK293 Homo sapiens (Human)  2
1
IC50 = 18400 nM
   TI
   LI
   LO
   TS
2
IC50 = 90000 nM
   TI
   LI
   LO
   TS
CL000017 HeLa Homo sapiens (Human)  1
1
IC50 = 77290 nM
   TI
   LI
   LO
   TS
CL000102 U-87MG ATCC Homo sapiens (Human)  1
1
IC50 = 18400 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 98500 nM
2 IC50 = 100000 nM
3 Ki = 19000 nM
4 Ki = 30000 nM
5 Ki = 34000 nM
6 Ki = 37000 nM
7 Ki = 42300 nM
8 Ki = 53200 nM
9 Km = 62000 nM