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Target
Cholinesterase
Ligand
BDBM50292241
Substrate
n/a
Meas. Tech.
ChEMBL_1731689 (CHEMBL4147225)
IC50
160±n/a nM
Citation
 Czarnecka, K; Chufarova, N; Halczuk, K; Maciejewska, K; Girek, M; Skibi?ski, R; Jo?czyk, J; Bajda, M; Kabzi?ski, J; Majsterek, I; Szyma?ski, P Tetrahydroacridine derivatives with dichloronicotinic acid moiety as attractive, multipotent agents for Alzheimer's disease treatment. Eur J Med Chem 145:760-769 (2018) [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:
BDBM50292241
Synonyms:
CHEMBL4159080
Type:
Small organic molecule
Emp. Form.:
C22H23Cl3N4O
Mol. Mass.:
465.803
SMILES:
Cl.Clc1cc(cnc1Cl)C(=O)NCCCNc1c2CCCCc2nc2ccccc12
Structure:
Search PDB for entries with ligand similarity: