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Target
Cholinesterase
Ligand
BDBM50139052
Substrate
n/a
Meas. Tech.
ChEMBL_1549984 (CHEMBL3755282)
IC50
3100±n/a nM
Citation
 Lemes, LF; de Andrade Ramos, G; de Oliveira, AS; da Silva, FM; de Castro Couto, G; da Silva Boni, M; Guimarães, MJ; Souza, IN; Bartolini, M; Andrisano, V; do Nascimento Nogueira, PC; Silveira, ER; Brand, GD; Soukup, O; Korábecný, J; Romeiro, NC; Castro, NG; Bolognesi, ML; Romeiro, LA Cardanol-derived AChE inhibitors: Towards the development of dual binding derivatives for Alzheimer's disease. Eur J Med Chem 108:687-700 (2016) [PubMed]  Article 
Target
Name:
Cholinesterase
Synonyms:
BCHE | Butyrylcholinesterase (BuChE) | CHLE_HORSE | Cholinesterase
Type:
Enzyme
Mol. Mass.:
65643.35
Organism:
Equus caballus (Horse)
Description:
P81908
Residue:
574
Sequence:
EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATKYANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQKNIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEARNRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLTDMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPRVSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYYFEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNPNGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAEREWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF
  
Inhibitor
Name:
BDBM50139052
Synonyms:
CHEMBL3754700
Type:
Small organic molecule
Emp. Form.:
C23H33NO2
Mol. Mass.:
355.5136
SMILES:
COc1cccc(CCCCCCCCNCc2ccccc2OC)c1
Structure:
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