Reaction Details Report a problem with these data
Target
Sialidase
Ligand
BDBM50355210
Substrate
n/a
Meas. Tech.
ChEMBL_772883 (CHEMBL1838286)
Ki
160±n/a nM
Citation
 Woo, HS; Kim, DW; Curtis-Long, MJ; Lee, BW; Lee, JH; Kim, JY; Kang, JE; Park, KH Potent inhibition of bacterial neuraminidase activity by pterocarpans isolated from the roots of Lespedeza bicolor. Bioorg Med Chem Lett 21:6100-3 (2011) [PubMed]  Article 
Target
Name:
Sialidase
Synonyms:
NANH_CLOPF | nanH
Type:
PROTEIN
Mol. Mass.:
42808.79
Organism:
Clostridium perfringens
Description:
ChEMBL_991336
Residue:
382
Sequence:
MCNKNNTFEKNLDISHKPEPLILFNKDNNIWNSKYFRIPNIQLLNDGTILTFSDIRYNGPDDHAYIDIASARSTDFGKTWSYNIAMKNNRIDSTYSRVMDSTTVITNTGRIILIAGSWNTNGNWAMTTSTRRSDWSVQMIYSDDNGLTWSNKIDLTKDSSKVKNQPSNTIGWLGGVGSGIVMDDGTIVMPAQISLRENNENNYYSLIIYSKDNGETWTMGNKVPNSNTSENMVIELDGALIMSTRYDYSGYRAAYISHDLGTTWEIYEPLNGKILTGKGSGCQGSFIKATTSNGHRIGLISAPKNTKGEYIRDNIAVYMIDFDDLSKGVQEICIPYPEDGNKLGGGYSCLSFKNNHLGIVYEANGNIEYQDLTPYYSLINKQ
  
Inhibitor
Name:
BDBM50355210
Synonyms:
CHEMBL1835715
Type:
Small organic molecule
Emp. Form.:
C27H32O5
Mol. Mass.:
436.54
SMILES:
[#6]-[#8]-c1c(-[#6]\[#6]=[#6](\[#6])-[#6])c(-[#8])cc2-[#8]-[#6]-[#6@@H]-3-[#6@@H](-[#8]-c4c-3cc(-[#6])c(-[#8])c4-[#6]\[#6]=[#6](\[#6])-[#6])-c12 |r|
Structure:
Search PDB for entries with ligand similarity: