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TargetAcetylcholinesterase
LigandBDBM50304247
Substrate/Competitorn/a
Meas. Tech.ChEMBL_605400 (CHEMBL1073394)
IC50 47±n/a nM
Citation Sheng, RLin, XZhang, JChol, KSHuang, WYang, BHe, QHu, Y Design, synthesis and evaluation of flavonoid derivatives as potent AChE inhibitors. Bioorg Med Chem17:6692-8 (2009) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Acetylcholinesterase
Name:Acetylcholinesterase
Synonyms:ACES_RAT | Acetylcholinesterase (AChE) | Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) | Acetylcholinesterase precursor | Acetylcholinesterase, AChE | Ache
Type:Enzyme
Mol. Mass.:68193.62
Organism:Rattus norvegicus (rat)
Description:P37136
Residue:614
Sequence:
MRPPWYPLHTPSLASPLLFLLLSLLGGGARAEGREDPQLLVRVRGGQLRGIRLKAPGGPV
SAFLGIPFAEPPVGSRRFMPPEPKRPWSGILDATTFQNVCYQYVDTLYPGFEGTEMWNPN
RELSEDCLYLNVWTPYPRPTSPTPVLIWIYGGGFYSGASSLDVYDGRFLAQVEGTVLVSM
NYRVGTFGFLALPGSREAPGNVGLLDQRLALQWVQENIAAFGGDPMSVTLFGESAGAASV
GMHILSLPSRSLFHRAVLQSGTPNGPWATVSAGEARRRATLLARLVGCPPGGAGGNDTEL
ISCLRTRPAQDLVDHEWHVLPQESIFRFSFVPVVDGDFLSDTPDALINTGDFQDLQVLVG
VVKDEGSYFLVYGVPGFSKDNESLISRAQFLAGVRIGVPQASDLAAEAVVLHYTDWLHPE
DPAHLRDAMSAVVGDHNVVCPVAQLAGRLAAQGARVYAYIFEHRASTLTWPLWMGVPHGY
EIEFIFGLPLDPSLNYTVEERIFAQRLMQYWTNFARTGDPNDPRDSKSPRWPPYTTAAQQ
YVSLNLKPLEVRRGLRAQTCAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKN
QFDHYSKQERCSDL
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50304247
n/a
NameBDBM50304247
Synonyms:(E)-1-(2-Hydroxy-4,5-dimethoxyphenyl)-3-[3-(pyrrolidin-1-ylmethyl)-phenyl]-prop-2-en-1-one | CHEMBL594225
TypeSmall organic molecule
Emp. Form.C21H23NO4
Mol. Mass.353.4116
SMILESCOc1cc(O)c(cc1OC)C(=O)\C=C\c1cccc(c1)N1CCCC1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: