Reaction Details |
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Target | Acetylcholinesterase |
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Ligand | BDBM50342604 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_744973 (CHEMBL1771988) |
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IC50 | 21800±n/a nM |
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Citation | Bolognesi, ML; Bartolini, M; Tarozzi, A; Morroni, F; Lizzi, F; Milelli, A; Minarini, A; Rosini, M; Hrelia, P; Andrisano, V; Melchiorre, C Multitargeted drugs discovery: balancing anti-amyloid and anticholinesterase capacity in a single chemical entity. Bioorg Med Chem Lett21:2655-8 (2011) [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 |
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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BDBM50342604 |
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n/a |
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Name | BDBM50342604 |
Synonyms: | 2,5-bis(3-(benzofuran-2-ylmethylamino)propylamino)cyclohexa-2,5-diene-1,4-dione | CHEMBL1770550 |
Type | Small organic molecule |
Emp. Form. | C30H32N4O4 |
Mol. Mass. | 512.5995 |
SMILES | Oc1cc(N=CCCNCc2cc3ccccc3o2)c(O)cc1NCCCNCc1cc2ccccc2o1 |w:4.3| |
Structure |
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