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Target
Decaprenylphosphoryl-beta-D-ribose oxidase
Ligand
BDBM50517951
Substrate
n/a
Meas. Tech.
ChEMBL_1870171 (CHEMBL4371338)
IC50
30±n/a nM
Citation
 Chikhale, RV; Barmade, MA; Murumkar, PR; Yadav, MR Overview of the Development of DprE1 Inhibitors for Combating the Menace of Tuberculosis. J Med Chem 61:8563-8593 (2018) [PubMed]  Article 
Target
Name:
Decaprenylphosphoryl-beta-D-ribose oxidase
Synonyms:
FAD-dependent decaprenylphosphoryl-beta-D-ribofuranose 2-oxidase | Decaprenylphosphoryl-beta-D-ribose 2-epimerase flavoprotein subunit | Decaprenylphosphoryl-beta-D-ribose oxidase | Decaprenylphospho-beta-D-ribofuranose 2-dehydrogenase | DPRE1_MYCTU | dprE1
Type:
PROTEIN
Mol. Mass.:
50167.60
Organism:
Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)
Description:
ChEMBL_116793
Residue:
461
Sequence:
MLSVGATTTATRLTGWGRTAPSVANVLRTPDAEMIVKAVARVAESGGGRGAIARGLGRSYGDNAQNGGGLVIDMTPLNTIHSIDADTKLVDIDAGVNLDQLMKAALPFGLWVPVLPGTRQVTVGGAIACDIHGKNHHSAGSFGNHVRSMDLLTADGEIRHLTPTGEDAELFWATVGGNGLTGIIMRATIEMTPTSTAYFIADGDVTASLDETIALHSDGSEARYTYSSAWFDAISAPPKLGRAAVSRGRLATVEQLPAKLRSEPLKFDAPQLLTLPDVFPNGLANKYTFGPIGELWYRKSGTYRGKVQNLTQFYHPLDMFGEWNRAYGPAGFLQYQFVIPTEAVDEFKKIIGVIQASGHYSFLNVFKLFGPRNQAPLSFPIPGWNICVDFPIKDGLGKFVSELDRRVLEFGGRLYTAKDSRTTAETFHAMYPRVDEWISVRRKVDPLRVFASDMARRLELL
  
Inhibitor
Name:
BDBM50517951
Synonyms:
CHEMBL4453252
Type:
Small organic molecule
Emp. Form.:
C17H13N7O2S
Mol. Mass.:
379.41
SMILES:
Cc1ccnc(NC(=O)c2ccsc2NC(=O)c2ccn3cnnc3c2)n1
Structure:
Search PDB for entries with ligand similarity: