Reaction Details Report a problem with these data
Target
Intracellular chorismate mutase
Ligand
BDBM50390439
Substrate
n/a
Meas. Tech.
ChEMBL_834286 (CHEMBL2073106)
IC50
19800±n/a nM
Citation
 Adepu, R; Shiva Kumar, K; Sandra, S; Rambabu, D; Rama Krishna, G; Malla Reddy, C; Kandale, A; Misra, P; Pal, M C-N bond formation under Cu-catalysis: synthesis and in vitro evaluation of N-aryl substituted thieno[2,3-d]pyrimidin-4(3H)-ones against chorismate mutase. Bioorg Med Chem 20:5127-38 (2012) [PubMed]  Article 
Target
Name:
Intracellular chorismate mutase
Synonyms:
CHMU_MYCTU | MT0975
Type:
PROTEIN
Mol. Mass.:
11771.52
Organism:
Mycobacterium tuberculosis
Description:
ChEMBL_834286
Residue:
105
Sequence:
MRPEPPHHENAELAAMNLEMLESQPVPEIDTLREEIDRLDAEILALVKRRAEVSKAIGKARMASGGTRLVHSREMKVIERYSELGPDGKDLAILLLRLGRGRLGH
  
Inhibitor
Name:
BDBM50390439
Synonyms:
CHEMBL2071368
Type:
Small organic molecule
Emp. Form.:
C17H16N2O2S
Mol. Mass.:
312.386
SMILES:
COc1cccc(c1)-n1cnc2sc3CCCCc3c2c1=O
Structure:
Search PDB for entries with ligand similarity: