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TargetAcetylcholinesterase
LigandBDBM50597594
Substrate/Competitorn/a
Meas. Tech.ChEMBL_2223705 (CHEMBL5137218)
IC50 30000±n/a nM
Citation de Andrade Ramos, GSouza de Oliveira, ABartolini, MNaldi, MLiparulo, IBergamini, CUliassi, EWu, LFraser, PEAbreu, MKiametis, ASGargano, RSilveira, ERBrand, GDPrchal, LSoukup, OKorábe?ný, JBolognesi, MLSoares Romeiro, LA Discovery of sustainable drugs for Alzheimer's disease: cardanol-derived cholinesterase inhibitors with antioxidant and anti-amyloid properties. RSC Med Chem12:1154-1163 (2021) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acetylcholinesterase
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:
MRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRGIRLKTPGGPV
SAFLGIPFAEPPMGPRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGTEMWNPN
RELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGFYSGASSLDVYDGRFLVQAERTVLVSM
NYRVGAFGFLALPGSREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGESAGAASV
GMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGEARRRATQLAHLVGCPPGGTGGNDTEL
VACLRTRPAQVLVNHEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHGLQVLVG
VVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGVRVGVPQVSDLAAEAVVLHYTDWLHPE
DPARLREALSDVVGDHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWMGVPHGY
EIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANFARTGDPNEPRDPKAPQWPPYTAGAQQ
YVSLDLRPLEVRRGLRAQACAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKN
QFDHYSKQDRCSDL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50597594
n/a
NameBDBM50597594
Synonyms:CHEMBL5183866
TypeSmall organic molecule
Emp. Form.C20H33NO2
Mol. Mass.319.4815
SMILESOCCCCCCCCc1ccc(CN2CCCCC2)c(O)c1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: