Reaction Details Report a problem with these data
Target
Beta-glucuronidase
Ligand
BDBM222195
Substrate
n/a
Meas. Tech.
β-Glucuronidase Assay
IC50
1.236e+4± 3.0e+2 nM
Citation
 Taha, M; Baharudin, MS; Ismail, NH; Selvaraj, M; Salar, U; Alkadi, KA; Khan, KM Synthesis and in silico studies of novel sulfonamides having oxadiazole ring: As ß-glucuronidase inhibitors. Bioorg Chem 71:86-96 (2017) [PubMed]  Article 
Target
Name:
Beta-glucuronidase
Synonyms:
β-Glucuronidase | BGLR_HUMAN | Beta-G1 | Beta-glucuronidase | GUSB | beta-Glucuronidase (β-glucuronidase)
Type:
Protein
Mol. Mass.:
74736.05
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
651
Sequence:
MARGSAVAWAALGPLLWGCALGLQGGMLYPQESPSRECKELDGLWSFRADFSDNRRRGFEEQWYRRPLWESGPTVDMPVPSSFNDISQDWRLRHFVGWVWYEREVILPERWTQDLRTRVVLRIGSAHSYAIVWVNGVDTLEHEGGYLPFEADISNLVQVGPLPSRLRITIAINNTLTPTTLPPGTIQYLTDTSKYPKGYFVQNTYFDFFNYAGLQRSVLLYTTPTTYIDDITVTTSVEQDSGLVNYQISVKGSNLFKLEVRLLDAENKVVANGTGTQGQLKVPGVSLWWPYLMHERPAYLYSLEVQLTAQTSLGPVSDFYTLPVGIRTVAVTKSQFLINGKPFYFHGVNKHEDADIRGKGFDWPLLVKDFNLLRWLGANAFRTSHYPYAEEVMQMCDRYGIVVIDECPGVGLALPQFFNNVSLHHHMQVMEEVVRRDKNHPAVVMWSVANEPASHLESAGYYLKMVIAHTKSLDPSRPVTFVSNSNYAADKGAPYVDVICLNSYYSWYHDYGHLELIQLQLATQFENWYKKYQKPIIQSEYGAETIAGFHQDPPLMFTEEYQKSLLEQYHLGLDQKRRKYVVGELIWNFADFMTEQSPTRVLGNKKGIFTRQRQPKSAAFLLRERYWKIANETRYPHSVAKSQCLENSLFT
  
Inhibitor
Name:
BDBM222195
Synonyms:
4-Chloro-N'-(4-(5-(2-methoxyphenyl)-1,3,4-oxadiazol-2yl)benzoyl)benzenesulfonohydrazide (3)
Type:
Small organic molecule
Emp. Form.:
C22H17ClN4O5S
Mol. Mass.:
484.912
SMILES:
COc1ccccc1-c1nnc(o1)-c1ccc(cc1)C(=O)NNS(=O)(=O)c1ccc(Cl)cc1
Structure:
Search PDB for entries with ligand similarity: