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Target
Urease subunit beta
Ligand
BDBM50467087
Substrate
n/a
Meas. Tech.
ChEMBL_1794866 (CHEMBL4266983)
IC50
27600±n/a nM
Citation
 Yang, YS; Su, MM; Zhang, XP; Liu, QX; He, ZX; Xu, C; Zhu, HL Developing potential Helicobacter pylori urease inhibitors from novel oxoindoline derivatives: Synthesis, biological evaluation and in silico study. Bioorg Med Chem Lett 28:3182-3186 (2018) [PubMed]  Article 
Target
Name:
Urease subunit beta
Synonyms:
3.5.1.5 | Urea amidohydrolase subunit beta | Urease subunit beta | ureB
Type:
PROTEIN
Mol. Mass.:
61708.53
Organism:
Helicobacter pylori
Description:
ChEMBL_100923
Residue:
569
Sequence:
MKKISRKEYVSMYGPTTGDKVRLGDTDLIAEVEHDYTIYGEELKFGGGKTLREGMSQSNNPSKEELDLIITNALIVDYTGIYKADIGIKDGKIAGIGKGGNKDMQDGVKNNLSVGPATEALAGEGLIVTAGGIDTHIHFISPQQIPTAFASGITTMIGGGTGPADGTNATTITPGRRNLKWMLRAAEEYSMNLGFLAKGNTSNDASLADQIEAGAIGFKIHEDWGTTPSAINHALDVADKYDVQVAIHTDTLNEAGCVEDTMAAIAGRTMHTFHTEGAGGGHAPDIIKVAGEHNILPASTNPTIPFTVNTEAEHMDMLMVCHHLDKSIKEDVQFADSRIRPQTIAAEDTLHDMGIFSITSSDSQAMGRVGEVITRTWQTADKNKKEFGRLKEEKGDNDNFRIKRYLSKYTINPAIAHGISEYVGSVEVGKVADLVLWSPAFFGVKPNMIIKGGFIALSQMGDANASIPTPQPVYYREMFAHHGKAKYDANITFVSKAAYDKGIKEELGLERQVLPVKNCRNITKKDMQFNDTTAHIEVNPETYHVFVDGKEVTSKPATKVSLAQLFSIF
  
Inhibitor
Name:
BDBM50467087
Synonyms:
CHEMBL4289842
Type:
Small organic molecule
Emp. Form.:
C20H18BrN3O2
Mol. Mass.:
412.28
SMILES:
[#6]\[#6](-[#6])=[#6]\[#6]-[#7]-1-[#6](=O)\[#6](=[#7]\[#7]-[#6](=O)-c2cccc(Br)c2)-c2ccccc-12
Structure:
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