Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetBeta-glucuronidase
LigandBDBM50028013
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1439804 (CHEMBL3386766)
IC50 900±n/a nM
Citation Mabkhot, YNBarakat, AYousuf, SChoudhary, MIFrey, WBen Hadda, TMubarak, MS Substituted thieno[2,3-b]thiophenes and related congeners: Synthesis,ß-glucuronidase inhibition activity, crystal structure, and POM analyses. Bioorg Med Chem22:6715-25 (2014) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Beta-glucuronidase
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:
MARGSAVAWAALGPLLWGCALGLQGGMLYPQESPSRECKELDGLWSFRADFSDNRRRGFE
EQWYRRPLWESGPTVDMPVPSSFNDISQDWRLRHFVGWVWYEREVILPERWTQDLRTRVV
LRIGSAHSYAIVWVNGVDTLEHEGGYLPFEADISNLVQVGPLPSRLRITIAINNTLTPTT
LPPGTIQYLTDTSKYPKGYFVQNTYFDFFNYAGLQRSVLLYTTPTTYIDDITVTTSVEQD
SGLVNYQISVKGSNLFKLEVRLLDAENKVVANGTGTQGQLKVPGVSLWWPYLMHERPAYL
YSLEVQLTAQTSLGPVSDFYTLPVGIRTVAVTKSQFLINGKPFYFHGVNKHEDADIRGKG
FDWPLLVKDFNLLRWLGANAFRTSHYPYAEEVMQMCDRYGIVVIDECPGVGLALPQFFNN
VSLHHHMQVMEEVVRRDKNHPAVVMWSVANEPASHLESAGYYLKMVIAHTKSLDPSRPVT
FVSNSNYAADKGAPYVDVICLNSYYSWYHDYGHLELIQLQLATQFENWYKKYQKPIIQSE
YGAETIAGFHQDPPLMFTEEYQKSLLEQYHLGLDQKRRKYVVGELIWNFADFMTEQSPTR
VLGNKKGIFTRQRQPKSAAFLLRERYWKIANETRYPHSVAKSQCLENSLFT
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50028013
n/a
NameBDBM50028013
Synonyms:CHEMBL3360798
TypeSmall organic molecule
Emp. Form.C33H42O8S2
Mol. Mass.630.812
SMILESCCOC(OCC)(OCC)\C=C\C(=O)c1sc2sc(C(=O)\C=C\C(OCC)(OCC)OCC)c(-c3ccccc3)c2c1C
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: