Reaction Details Report a problem with these data
Target
Tryptophan 2,3-dioxygenase
Ligand
BDBM50289137
Substrate
n/a
Meas. Tech.
ChEMBL_1802610 (CHEMBL4274902)
IC50
377±n/a nM
Citation
 Pan, L; Zheng, Q; Chen, Y; Yang, R; Yang, Y; Li, Z; Meng, X Design, synthesis and biological evaluation of novel naphthoquinone derivatives as IDO1 inhibitors. Eur J Med Chem 157:423-436 (2018) [PubMed]  Article 
Target
Name:
Tryptophan 2,3-dioxygenase
Synonyms:
T23O_HUMAN | TDO | TDO2 | TO | TRPO | Tryptamin 2,3-dioxygenase | Tryptophan oxygenase | Tryptophan pyrrolase | Tryptophanase
Type:
PROTEIN
Mol. Mass.:
47874.48
Organism:
Homo sapiens (Human)
Description:
ChEMBL_825691
Residue:
406
Sequence:
MSGCPFLGNNFGYTFKKLPVEGSEEDKSQTGVNRASKGGLIYGNYLHLEKVLNAQELQSETKGNKIHDEHLFIITHQAYELWFKQILWELDSVREIFQNGHVRDERNMLKVVSRMHRVSVILKLLVQQFSILETMTALDFNDFREYLSPASGFQSLQFRLLENKIGVLQNMRVPYNRRHYRDNFKGEENELLLKSEQEKTLLELVEAWLERTPGLEPHGFNFWGKLEKNITRGLEEEFIRIQAKEESEEKEEQVAEFQKQKEVLLSLFDEKRHEHLLSKGERRLSYRALQGALMIYFYREEPRFQVPFQLLTSLMDIDSLMTKWRYNHVCMVHRMLGSKAGTGGSSGYHYLRSTVSDRYKVFVDLFNLSTYLIPRHWIPKMNPTIHKFLYTAEYCDSSYFSSDESD
  
Inhibitor
Name:
BDBM50289137
Synonyms:
6-Fluoro-3-((E)-2-pyridin-3-yl-vinyl)-1H-indole | CHEMBL355606 | US10155972, Compound 680C91
Type:
Small organic molecule
Emp. Form.:
C15H11FN2
Mol. Mass.:
238.2596
SMILES:
Fc1ccc2c(\C=C\c3cccnc3)c[nH]c2c1
Structure:
Search PDB for entries with ligand similarity: