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TargetAcetylcholinesterase
LigandBDBM50106731
Substrate/Competitorn/a
Meas. Tech.ChEMBL_462117 (CHEMBL945890)
IC50 1±n/a nM
Citation Cavalli, ABolognesi, MLMinarini, ARosini, MTumiatti, VRecanatini, MMelchiorre, C Multi-target-directed ligands to combat neurodegenerative diseases. J Med Chem51:347-72 (2008) [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:
BDBM50106731
n/a
NameBDBM50106731
Synonyms:(+)-alpha-Lipoic acid | (R)-(+)-lipoic acid | (R)-1,2-Dithiolane-3-pentanoic acid | (R)-lipoic acid | 5-[(3R)-1,2-dithiolan-3-yl]pentanoic acid | CHEMBL134342 | Lipoic acid | Thioctic acid | Thioctic acid d-form | alpha-Lipoic acid
TypeSmall organic molecule
Emp. Form.C8H14O2S2
Mol. Mass.206.326
SMILESOC(=O)CCCC[C@@H]1CCSS1 |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: