| Reaction Details |
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 | Report a problem with these data |
| Target | Acetylcholinesterase |
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| Ligand | BDBM50124570 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_28749 (CHEMBL641013) |
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| Ki | 12.2±n/a nM |
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| Citation |  Tumiatti, V; Rosini, M; Bartolini, M; Cavalli, A; Marucci, G; Andrisano, V; Angeli, P; Banzi, R; Minarini, A; Recanatini, M; Melchiorre, C Structure-activity relationships of acetylcholinesterase noncovalent inhibitors based on a polyamine backbone. 2. Role of the substituents on the phenyl ring and nitrogen atoms of caproctamine. J Med Chem46:954-66 (2003) [PubMed] Article |
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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 |
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| Synonyms: | ACES_HUMAN | ACHE | Acetylcholinesterase (AChE) | Acetylcholinesterase (human AChE) |
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| Type: | Enzyme |
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| Mol. Mass.: | 67792.70 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P22303 |
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| Residue: | 614 |
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| Sequence: | MRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRGIRLKTPGGPV
SAFLGIPFAEPPMGPRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGTEMWNPN
RELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGFYSGASSLDVYDGRFLVQAERTVLVSM
NYRVGAFGFLALPGSREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGESAGAASV
GMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGEARRRATQLAHLVGCPPGGTGGNDTEL
VACLRTRPAQVLVNHEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHGLQVLVG
VVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGVRVGVPQVSDLAAEAVVLHYTDWLHPE
DPARLREALSDVVGDHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWMGVPHGY
EIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANFARTGDPNEPRDPKAPQWPPYTAGAQQ
YVSLDLRPLEVRRGLRAQACAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKN
QFDHYSKQDRCSDL
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| BDBM50124570 |
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| n/a |
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| Name | BDBM50124570 |
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| Synonyms: | 6-[Ethyl-(2-methoxy-benzyl)-amino]-hexanoic acid [8-({6-[ethyl-(2-methoxy-benzyl)-amino]-hexanoyl}-methyl-amino)-octyl]-methyl-amide | CHEMBL173309 | CHEMBL385130 | N,N''-(octane-1,8-diyl)bis(6-(ethyl(2-methoxybenzyl)amino)-N-methylhexanamide) |
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| Type | Small organic molecule |
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| Emp. Form. | C42H70N4O4 |
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| Mol. Mass. | 695.0296 |
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| SMILES | CCN(CCCCCC(=O)N(C)CCCCCCCCN(C)C(=O)CCCCCN(CC)Cc1ccccc1OC)Cc1ccccc1OC |
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| Structure | 
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