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Target
Acetylcholinesterase
Ligand
BDBM50467893
Substrate
n/a
Meas. Tech.
ChEMBL_1797268 (CHEMBL4269385)
IC50
66±n/a nM
Citation
 Lopes, JPB; Silva, L; da Costa Franarin, G; Antonio Ceschi, M; Seibert Lüdtke, D; Ferreira Dantas, R; de Salles, CMC; Paes Silva-Jr, F; Roberto Senger, M; Alvim Guedes, I; Emmanuel Dardenne, L Design, synthesis, cholinesterase inhibition and molecular modelling study of novel tacrine hybrids with carbohydrate derivatives. Bioorg Med Chem 26:5566-5577 (2018) [PubMed]  Article 
Target
Name:
Acetylcholinesterase
Synonyms:
ACES_MOUSE | Acetylcholinesterase (AChE) | Acetylcholinesterase (mouse AChE) | Acetylcholinesterase precursor | Ache
Type:
Enzyme
Mol. Mass.:
68165.65
Organism:
Mus musculus (mouse)
Description:
n/a
Residue:
614
Sequence:
MRPPWYPLHTPSLAFPLLFLLLSLLGGGARAEGREDPQLLVRVRGGQLRGIRLKAPGGPVSAFLGIPFAEPPVGSRRFMPPEPKRPWSGVLDATTFQNVCYQYVDTLYPGFEGTEMWNPNRELSEDCLYLNVWTPYPRPASPTPVLIWIYGGGFYSGAASLDVYDGRFLAQVEGAVLVSMNYRVGTFGFLALPGSREAPGNVGLLDQRLALQWVQENIAAFGGDPMSVTLFGESAGAASVGMHILSLPSRSLFHRAVLQSGTPNGPWATVSAGEARRRATLLARLVGCPPGGAGGNDTELIACLRTRPAQDLVDHEWHVLPQESIFRFSFVPVVDGDFLSDTPEALINTGDFQDLQVLVGVVKDEGSYFLVYGVPGFSKDNESLISRAQFLAGVRIGVPQASDLAAEAVVLHYTDWLHPEDPTHLRDAMSAVVGDHNVVCPVAQLAGRLAAQGARVYAYIFEHRASTLTWPLWMGVPHGYEIEFIFGLPLDPSLNYTTEERIFAQRLMKYWTNFARTGDPNDPRDSKSPQWPPYTTAAQQYVSLNLKPLEVRRGLRAQTCAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKNQFDHYSKQERCSDL
  
Inhibitor
Name:
BDBM50467893
Synonyms:
CHEMBL4276832
Type:
Small organic molecule
Emp. Form.:
C31H47N3O4
Mol. Mass.:
525.7226
SMILES:
[H][C@]12OC(C)(C)O[C@@]1([H])[C@H](OC)O[C@@H]2CNCCCCCCCCCNc1c2CCCCc2nc2ccccc12 |r|
Structure:
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