Reaction Details |
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Target | Cholinesterase |
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Ligand | BDBM50564592 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_2088339 (CHEMBL4769602) |
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Ki | 920±n/a nM |
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Citation | Bortolami, M; Pandolfi, F; De Vita, D; Carafa, C; Messore, A; Di Santo, R; Feroci, M; Costi, R; Chiarotto, I; Bagetta, D; Alcaro, S; Colone, M; Stringaro, A; Scipione, L New deferiprone derivatives as multi-functional cholinesterase inhibitors: design, synthesis and in vitro evaluation. Eur J Med Chem198:0 (2020) [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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BDBM50564592 |
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n/a |
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Name | BDBM50564592 |
Synonyms: | CHEMBL4798261 |
Type | Small organic molecule |
Emp. Form. | C23H29N5O2 |
Mol. Mass. | 407.5087 |
SMILES | Cc1c(O)c(=O)ccn1CCCCCCNc1ccnc(NCc2ccccc2)n1 |
Structure |
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