Reaction Details |
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Target | Cholinesterase |
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Ligand | BDBM50463665 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1778964 (CHEMBL4235956) |
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Ki | 1550±n/a nM |
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Citation | Makhaeva, GF; Boltneva, NP; Lushchekina, SV; Rudakova, EV; Serebryakova, OG; Kulikova, LN; Beloglazkin, AA; Borisov, RS; Richardson, RJ Synthesis, molecular docking, and biological activity of 2-vinyl chromones: Toward selective butyrylcholinesterase inhibitors for potential Alzheimer's disease therapeutics. Bioorg Med Chem26:4716-4725 (2018) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Cholinesterase |
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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
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BDBM50463665 |
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n/a |
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Name | BDBM50463665 |
Synonyms: | CHEMBL4240365 |
Type | Small organic molecule |
Emp. Form. | C23H20BrNO4 |
Mol. Mass. | 454.313 |
SMILES | COC(=O)\C=C\N(Cc1ccccc1)Cc1c(C=C)oc2ccc(Br)cc2c1=O |
Structure |
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