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Target
Acetylcholinesterase
Ligand
BDBM50139006
Substrate
n/a
Meas. Tech.
ChEMBL_1549993 (CHEMBL3755444)
Ki
10400±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:
Acetylcholinesterase
Synonyms:
ACES_ELEEL | Acetylcholinesterase (AChE) | Acetylcholinesterase (EeAChE) | ache
Type:
Enzyme
Mol. Mass.:
71812.79
Organism:
Electrophorus electricus (Electric eel)
Description:
n/a
Residue:
633
Sequence:
MKILDALLFPVIFIMFFIHLSIAQTDPELTIMTRLGQVQGTRLPVPDRSHVIAFLGIPFAEPPLGKMRFKPPEPKKPWNDVFDARDYPSACYQYVDTSYPGFSGTEMWNPNRMMSEDCLYLNVWVPATPRPHNLTVMVWIYGGGFYSGSSSLDVYDGRYLAHSEKVVVVSMNYRVSAFGFLALNGSAEAPGNVGLLDQRLALQWVQDNIHFFGGNPKQVTIFGESAGAASVGMHLLSPDSRPKFTRAILQSGVPNGPWRTVSFDEARRRAIKLGRLVGCPDGNDTDLIDCLRSKQPQDLIDQEWLVLPFSGLFRFSFVPVIDGVVFPDTPEAMLNSGNFKDTQILLGVNQNEGSYFLIYGAPGFSKDNESLITREDFLQGVKMSVPHANEIGLEAVILQYTDWMDEDNPIKNREAMDDIVGDHNVVCPLQHFAKMYAQYSILQGQTGTASQGNLGWGNSGSASNSGNSQVSVYLYMFDHRASNLVWPEWMGVIHGYEIEFVFGLPLEKRLNYTLEEEKLSRRMMKYWANFARTGNPNINVDGSIDSRRRWPVFTSTEQKHVGLNTDSLKVHKGLKSQFCALWNRFLPRLLNVTENIDDAERQWKAEFHRWSSYMMHWKNQFDHYSKQERCTNL
  
Inhibitor
Name:
BDBM50139006
Synonyms:
CHEMBL3753607
Type:
Small organic molecule
Emp. Form.:
C24H35NO
Mol. Mass.:
353.5408
SMILES:
CCN(CCCCCCCCc1cccc(OC)c1)Cc1ccccc1
Structure:
Search PDB for entries with ligand similarity: