Reaction Details |
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Target | Acetylcholinesterase |
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Ligand | BDBM50108395 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEBML_28306 |
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IC50 | 330±n/a nM |
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Citation | Grove, SJ; Kaur, J; Muir, AW; Pow, E; Tarver, GJ; Zhang, MQ Oxyaniliniums as acetylcholinesterase inhibitors for the reversal of neuromuscular block. Bioorg Med Chem Lett12:193-6 (2001) [PubMed] |
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More Info.: | Get all data from this article, Assay Method |
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Acetylcholinesterase |
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Name: | Acetylcholinesterase |
Synonyms: | ACES_HUMAN | ACHE | Acetylcholinesterase (AChE) | Acetylcholinesterase (human AChE) |
Type: | Enzyme |
Mol. Mass.: | 67792.70 |
Organism: | Homo sapiens (Human) |
Description: | P22303 |
Residue: | 614 |
Sequence: | MRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRGIRLKTPGGPV
SAFLGIPFAEPPMGPRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGTEMWNPN
RELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGFYSGASSLDVYDGRFLVQAERTVLVSM
NYRVGAFGFLALPGSREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGESAGAASV
GMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGEARRRATQLAHLVGCPPGGTGGNDTEL
VACLRTRPAQVLVNHEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHGLQVLVG
VVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGVRVGVPQVSDLAAEAVVLHYTDWLHPE
DPARLREALSDVVGDHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWMGVPHGY
EIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANFARTGDPNEPRDPKAPQWPPYTAGAQQ
YVSLDLRPLEVRRGLRAQACAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKN
QFDHYSKQDRCSDL
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BDBM50108395 |
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n/a |
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Name | BDBM50108395 |
Synonyms: | Benzyl-{3-[2-(3,4-dimethoxy-phenyl)-2-oxo-ethoxy]-phenyl}-dimethyl-ammonium; bromide | CHEMBL60074 |
Type | Small organic molecule |
Emp. Form. | C25H28NO4 |
Mol. Mass. | 406.4936 |
SMILES | COc1ccc(cc1OC)C(=O)COc1cccc(c1)[N+](C)(C)Cc1ccccc1 |
Structure |
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