Reaction Details |
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Target | Cholinesterase |
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Ligand | BDBM10960 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_615850 (CHEMBL1101960) |
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IC50 | 240±n/a nM |
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Citation | Takahashi, J; Hijikuro, I; Kihara, T; Murugesh, MG; Fuse, S; Kunimoto, R; Tsumura, Y; Akaike, A; Niidome, T; Okuno, Y; Takahashi, T; Sugimoto, H Design, synthesis, evaluation and QSAR analysis of N(1)-substituted norcymserine derivatives as selective butyrylcholinesterase inhibitors. Bioorg Med Chem Lett20:1718-20 (2010) [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: | Acylcholine acylhydrolase | Bche | Butyrylcholine esterase | Butyrylcholinesterase | CHLE_MOUSE | Choline esterase II | Pseudocholinesterase |
Type: | Protein |
Mol. Mass.: | 68465.99 |
Organism: | Mus musculus (Mouse) |
Description: | Q03311 |
Residue: | 603 |
Sequence: | MQTQHTKVTQTHFLLWILLLCMPFGKSHTEEDFIITTKTGRVRGLSMPVLGGTVTAFLGI
PYAQPPLGSLRFKKPQPLNKWPDIHNATQYANSCYQNIDQAFPGFQGSEMWNPNTNLSED
CLYLNVWIPVPKPKNATVMVWIYGGGFQTGTSSLPVYDGKFLARVERVIVVSMNYRVGAL
GFLAFPGNPDAPGNMGLFDQQLALQWVQRNIAAFGGNPKSITIFGESAGAASVSLHLLCP
QSYPLFTRAILESGSSNAPWAVKHPEEARNRTLTLAKFTGCSKENEMEMIKCLRSKDPQE
ILRNERFVLPSDSILSINFGPTVDGDFLTDMPHTLLQLGKVKKAQILVGVNKDEGTAFLV
YGAPGFSKDNDSLITRKEFQEGLNMYFPGVSRLGKEAVLFYYVDWLGEQSPEVYRDALDD
VIGDYNIICPALEFTKKFAELENNAFFYFFEHRSSKLPWPEWMGVMHGYEIEFVFGLPLG
RRVNYTRAEEIFSRSIMKTWANFAKYGHPNGTQGNSTMWPVFTSTEQKYLTLNTEKSKIY
SKLRAPQCQFWRLFFPKVLEMTGDIDETEQEWKAGFHRWSNYMMDWQNQFNDYTSKKESC
TAL
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BDBM10960 |
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n/a |
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Name | BDBM10960 |
Synonyms: | (3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-5-yl N-[4-(propan-2-yl)phenyl]carbamate | 4-isopropylphenserine | Cymserine | cymserine.tartaric acid |
Type | Small organic molecule |
Emp. Form. | C23H29N3O2 |
Mol. Mass. | 379.4953 |
SMILES | [H][C@]12N(C)CC[C@@]1(C)c1cc(OC(=O)Nc3ccc(cc3)C(C)C)ccc1N2C |r| |
Structure |
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