Reaction Details Report a problem with these data
Target
Pantothenate synthetase
Ligand
BDBM50497761
Substrate
n/a
Meas. Tech.
ChEMBL_1452794 (CHEMBL3365136)
IC50
1990±n/a nM
Citation
 Samala, G; Nallangi, R; Devi, PB; Saxena, S; Yadav, R; Sridevi, JP; Yogeeswari, P; Sriram, D Identification and development of 2-methylimidazo[1,2-a]pyridine-3-carboxamides as Mycobacterium tuberculosis pantothenate synthetase inhibitors. Bioorg Med Chem 22:4223-32 (2014) [PubMed]  Article 
Target
Name:
Pantothenate synthetase
Synonyms:
Chain A, Crystal Structure Of A Pantothenate Synthetase, Apo Enzyme In C2 Space Group | PANC_MYCTU | Pantothenate synthetase | panC
Type:
n/a
Mol. Mass.:
32675.10
Organism:
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:
ChEMBL_102878
Residue:
309
Sequence:
MTIPAFHPGELNVYSAPGDVADVSRALRLTGRRVMLVPTMGALHEGHLALVRAAKRVPGSVVVVSIFVNPMQFGAGEDLDAYPRTPDDDLAQLRAEGVEIAFTPTTAAMYPDGLRTTVQPGPLAAELEGGPRPTHFAGVLTVVLKLLQIVRPDRVFFGEKDYQQLVLIRQLVADFNLDVAVVGVPTVREADGLAMSSRNRYLDPAQRAAAVALSAALTAAAHAATAGAQAALDAARAVLDAAPGVAVDYLELRDIGLGPMPLNGSGRLLVAARLGTTRLLDNIAIEIGTFAGTDRPDGYRAILESHWRN
  
Inhibitor
Name:
BDBM50497761
Synonyms:
CHEMBL1487172
Type:
Small organic molecule
Emp. Form.:
C15H19N3O
Mol. Mass.:
257.3309
SMILES:
Cc1nc2ccccn2c1C(=O)NC1CCCCC1
Structure:
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