Reaction Details Report a problem with these data
Target
Acetylcholinesterase
Ligand
BDBM293402
Substrate
n/a
Meas. Tech.
Measurement of IC50 of Eckol Derivatives Against Acetylcholinesterase and Butyrylcholinesterase
pH
7.4±n/a
Temperature
298.15±n/a K
IC50
41900±n/a nM
Comments
extracted
Citation
 Shin, H; Hwang, H; Park, KY; Kim, SH; Lee, H Eckol derivatives, methods of synthesis and uses thereof US Patent  US10106521 Publication Date 10/23/2018 
Target
Name:
Acetylcholinesterase
Synonyms:
ACES_HUMAN | ACHE | Acetylcholinesterase (AChE) | Acetylcholinesterase (human AChE)
Type:
Enzyme
Mol. Mass.:
67792.70
Organism:
Homo sapiens (Human)
Description:
P22303
Residue:
614
Sequence:
MRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRGIRLKTPGGPVSAFLGIPFAEPPMGPRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGTEMWNPNRELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGFYSGASSLDVYDGRFLVQAERTVLVSMNYRVGAFGFLALPGSREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGESAGAASVGMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGEARRRATQLAHLVGCPPGGTGGNDTELVACLRTRPAQVLVNHEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHGLQVLVGVVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGVRVGVPQVSDLAAEAVVLHYTDWLHPEDPARLREALSDVVGDHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWMGVPHGYEIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANFARTGDPNEPRDPKAPQWPPYTAGAQQYVSLDLRPLEVRRGLRAQACAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKNQFDHYSKQDRCSDL
  
Inhibitor
Name:
BDBM293402
Synonyms:
US10106521, Compound 9''-O-Benzyl Dieckol
Type:
Small organic molecule
Emp. Form.:
C43H28O18
Mol. Mass.:
832.6716
SMILES:
Oc1cc(O)cc(Oc2c(O)cc(O)c3Oc4cc(Oc5c(O)cc(Oc6c(O)cc(O)c7Oc8cc(O)cc(O)c8Oc67)cc5O)cc(OCc5ccccc5)c4Oc23)c1
Structure:
Search PDB for entries with ligand similarity: