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Target
Pantothenate synthetase
Ligand
BDBM50277209
Substrate
n/a
Meas. Tech.
ChEBML_1717739
IC50
1010±n/a nM
Citation
 Xu, Z; Gao, C; Ren, QC; Song, XF; Feng, LS; Lv, ZS Recent advances of pyrazole-containing derivatives as anti-tubercular agents. Eur J Med Chem 139:429-440 (2017) [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:
BDBM50277209
Synonyms:
CHEMBL4170233
Type:
Small organic molecule
Emp. Form.:
C23H23N7O2
Mol. Mass.:
429.4744
SMILES:
COc1ccc(cc1)-n1cc(Cn2ncc3CN(CCc23)C(=O)Nc2ccccc2)nn1
Structure:
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