| Reaction Details |
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 | Report a problem with these data |
| Target | Cholinesterase |
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| Ligand | BDBM50050573 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1458378 (CHEMBL3369808) |
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| IC50 | 23600±n/a nM |
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| Citation |  Alza, NP; Richmond, V; Baier, CJ; Freire, E; Baggio, R; Murray, AP Synthesis and cholinesterase inhibition of cativic acid derivatives. Bioorg Med Chem22:3838-49 (2014) [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 |
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| Synonyms: | BCHE | Butyrylcholinesterase (BuChE) | CHLE_HORSE | Cholinesterase |
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| Type: | Enzyme |
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| Mol. Mass.: | 65643.35 |
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| Organism: | Equus caballus (Horse) |
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| Description: | P81908 |
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| Residue: | 574 |
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| Sequence: | EEDIIITTKNGKVRGMNLPVLGGTVTAFLGIPYAQPPLGRLRFKKPQSLTKWSNIWNATK
YANSCYQNTDQSFPGFLGSEMWNPNTELSEDCLYLNVWIPAPKPKNATVMIWIYGGGFQT
GTSSLPVYDGKFLARVERVIVVSMNYRVGALGFLALSENPEAPGNMGLFDQQLALQWVQK
NIAAFGGNPRSVTLFGESAGAASVSLHLLSPRSQPLFTRAILQSGSSNAPWAVTSLYEAR
NRTLTLAKRMGCSRDNETEMIKCLRDKDPQEILLNEVFVVPYDTLLSVNFGPTVDGDFLT
DMPDTLLQLGQFKRTQILVGVNKDEGTAFLVYGAPGFSKDNNSIITRKEFQEGLKIFFPR
VSEFGRESILFHYMDWLDDQRAENYREALDDVVGDYNIICPALEFTRKFSELGNDAFFYY
FEHRSTKLPWPEWMGVMHGYEIEFVFGLPLERRVNYTRAEEILSRSIMKRWANFAKYGNP
NGTQNNSTRWPVFKSTEQKYLTLNTESPKVYTKLRAQQCRFWTLFFPKVLELTGNIDEAE
REWKAGFHRWNNYMMDWKNQFNDYTSKKESCSDF
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| BDBM50050573 |
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| n/a |
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| Name | BDBM50050573 |
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| Synonyms: | CHEMBL3311544 |
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| Type | Small organic molecule |
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| Emp. Form. | C28H51NO3 |
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| Mol. Mass. | 449.7094 |
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| SMILES | [H][C@@]12CC=C(CO)[C@H](CC[C@H](C)CC(=O)OCCCCN(CC)CC)[C@@]1(C)CCCC2(C)C |r,t:3| |
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| Structure | 
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