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TargetCholinesterase
LigandBDBM50292422
Substrate/Competitorn/a
Meas. Tech.ChEMBL_1732723 (CHEMBL4148259)
IC50 33860±n/a nM
Citation Dias Viegas, FPde Freitas Silva, MDivino da Rocha, MCastelli, MRRiquiel, MMMachado, RPVaz, SMSimões de Lima, LMMancini, KCMarques de Oliveira, PCMorais, ÉPGontijo, VSda Silva, FMRD'Alincourt da Fonseca Peçanha, DCastro, NGNeves, GAGiusti-Paiva, AVilela, FCOrlandi, LCamps, IVeloso, MPLeomil Coelho, LFIonta, MFerreira-Silva, GÁPereira, RMDardenne, LEGuedes, IAde Oliveira Carneiro Junior, WQuaglio Bellozi, PMPinheiro de Oliveira, ACFerreira, FFPruccoli, LTarozzi, AViegas, C Design, synthesis and pharmacological evaluation of N-benzyl-piperidinyl-aryl-acylhydrazone derivatives as donepezil hybrids: Discovery of novel multi-target anti-alzheimer prototype drug candidates. Eur J Med Chem147:48-65 (2018) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Cholinesterase
Name:Cholinesterase
Synonyms:BCHE | Butyrylcholinesterase (BuChE) | CHLE_HORSE | Cholinesterase
Type:Enzyme
Mol. Mass.:65643.35
Organism:Equus caballus (Horse)
Description:P81908
Residue:574
Sequence:
EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATK
YANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQT
GTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQK
NIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEAR
NRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLT
DMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPR
VSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYY
FEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNP
NGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAE
REWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50292422
n/a
NameBDBM50292422
Synonyms:CHEMBL4175724
TypeSmall organic molecule
Emp. Form.C20H22N4O4
Mol. Mass.382.4131
SMILESOC1CCCN(Cc2ccc(cc2)C(=O)N\N=C\c2ccc(cc2)[N+]([O-])=O)C1
Structure
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