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Target
Sialidase
Ligand
BDBM50317439
Substrate
n/a
Meas. Tech.
ChEMBL_631810 (CHEMBL1109003)
IC50
26390±n/a nM
Citation
 Nguyen, PH; Nguyen, TN; Kang, KW; Ndinteh, DT; Mbafor, JT; Kim, YR; Oh, WK Prenylated pterocarpans as bacterial neuraminidase inhibitors. Bioorg Med Chem 18:3335-44 (2010) [PubMed]  Article 
Target
Name:
Sialidase
Synonyms:
NANH_VIBCH | nanH
Type:
PROTEIN
Mol. Mass.:
85590.05
Organism:
Vibrio cholerae
Description:
ChEMBL_631810
Residue:
781
Sequence:
MRFKNVKKTALMLAMFGMATSSNAALFDYNATGDTEFDSPAKQGWMQDNTNNGSGVLTNADGMPAWLVQGIGGRAQWTYSLSTNQHAQASSFGWRMTTEMKVLSGGMITNYYANGTQRVLPIISLDSSGNLVVEFEGQTGRTVLATGTAATEYHKFELVFLPGSNPSASFYFDGKLIRDNIQPTASKQNMIVWGNGSSNTDGVAAYRDIKFEIQGDVIFRGPDRIPSIVASSVTPGVVTAFAEKRVGGGDPGALSNTNDIITRTSRDGGITWDTELNLTEQINVSDEFDFSDPRPIYDPSSNTVLVSYARWPTDAAQNGDRIKPWMPNGIFYSVYDVASGNWQAPIDVTDQVKERSFQIAGWGGSELYRRNTSLNSQQDWQSNAKIRIVDGAANQIQVADGSRKYVVTLSIDESGGLVANLNGVSAPIILQSEHAKVHSFHDYELQYSALNHTTTLFVDGQQITTWAGEVSQENNIQFGNADAQIDGRLHVQKIVLTQQGHNLVEFDAFYLAQQTPEVEKDLEKLGWTKIKTGNTMSLYGNASVNPGPGHGITLTRQQNISGSQNGRLIYPAIVLDRFFLNVMSIYSDDGGSNWQTGSTLPIPFRWKSSSILETLEPSEADMVELQNGDLLLTARLDFNQIVNGVNYSPRQQFLSKDGGITWSLLEANNANVFSNISTGTVDASITRFEQSDGSHFLLFTNPQGNPAGTNGRQNLGLWFSFDEGVTWKGPIQLVNGASAYSDIYQLDSENAIVIVETDNSNMRILRMPITLLKQKLTLSQN
  
Inhibitor
Name:
BDBM50317439
Synonyms:
CHEMBL1095422 | erysubin D
Type:
Small organic molecule
Emp. Form.:
C25H28O5
Mol. Mass.:
408.4868
SMILES:
[#6]\[#6](-[#6])=[#6]\[#6]-c1cc2-[#6@@H]-3-[#8]-c4c(ccc5-[#8]C([#6])([#6])[#6](-[#8])-[#6]-c45)-[#6@@H]-3-[#6]-[#8]-c2cc1-[#8] |r|
Structure:
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