Reaction Details Report a problem with these data
Target
Tryptophan 2,3-dioxygenase
Ligand
BDBM48009
Substrate
n/a
Meas. Tech.
ChEMBL_1882017 (CHEMBL4383516)
Ki
336±n/a nM
Citation
 Zhang, S; Qi, F; Fang, X; Yang, D; Hu, H; Huang, Q; Kuang, C; Yang, Q Tryptophan 2,3-dioxygenase inhibitory activities of tryptanthrin derivatives. Eur J Med Chem 160:133-145 (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:
BDBM48009
Synonyms:
8-fluoranylindolo[2,1-b]quinazoline-6,12-dione | 8-fluoroindolo[2,1-b]quinazoline-6,12-dione | 8-fluoroindolo[2,1-b]quinazoline-6,12-quinone | MLS001216278 | SMR000544298 | US10669273, Compound 5c | cid_478574
Type:
Small organic molecule
Emp. Form.:
C15H7FN2O2
Mol. Mass.:
266.2267
SMILES:
Fc1ccc-2c(c1)C(=O)c1nc3ccccc3c(=O)n-21
Structure:
Search PDB for entries with ligand similarity: