Reaction Details |
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Target | Acetylcholinesterase |
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Ligand | BDBM50308417 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_613958 (CHEMBL1068998) |
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Ki | 16300±n/a nM |
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Citation | Darvesh, S; Pottie, IR; Darvesh, KV; McDonald, RS; Walsh, R; Conrad, S; Penwell, A; Mataija, D; Martin, E Differential binding of phenothiazine urea derivatives to wild-type human cholinesterases and butyrylcholinesterase mutants. Bioorg Med Chem18:2232-44 (2010) [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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BDBM50308417 |
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n/a |
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Name | BDBM50308417 |
Synonyms: | CHEMBL601282 | N-[2-(N',N'-Diethylamino)ethyl]-1'H-phenothiazine-1'-carboxamide hydrochloride salt |
Type | Small organic molecule |
Emp. Form. | C19H23N3OS |
Mol. Mass. | 341.47 |
SMILES | CCN(CC)CCNC(=O)N1c2ccccc2Sc2ccccc12 |
Structure |
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