Reaction Details |
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Target | Acetylcholinesterase |
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Ligand | BDBM50335637 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_715592 (CHEMBL1663475) |
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IC50 | 13000±n/a nM |
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Citation | Tomassoli, I; Ismaili, L; Pudlo, M; de Los Ríos, C; Soriano, E; Colmena, I; Gandía, L; Rivas, L; Samadi, A; Marco-Contelles, J; Refouvelet, B Synthesis, biological assessment and molecular modeling of new dihydroquinoline-3-carboxamides and dihydroquinoline-3-carbohydrazide derivatives as cholinesterase inhibitors, and Ca channel antagonists. Eur J Med Chem46:1-10 (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_ELEEL | Acetylcholinesterase (AChE) | Acetylcholinesterase (EeAChE) | ache |
Type: | Enzyme |
Mol. Mass.: | 71812.79 |
Organism: | Electrophorus electricus (Electric eel) |
Description: | n/a |
Residue: | 633 |
Sequence: | MKILDALLFPVIFIMFFIHLSIAQTDPELTIMTRLGQVQGTRLPVPDRSHVIAFLGIPFA
EPPLGKMRFKPPEPKKPWNDVFDARDYPSACYQYVDTSYPGFSGTEMWNPNRMMSEDCLY
LNVWVPATPRPHNLTVMVWIYGGGFYSGSSSLDVYDGRYLAHSEKVVVVSMNYRVSAFGF
LALNGSAEAPGNVGLLDQRLALQWVQDNIHFFGGNPKQVTIFGESAGAASVGMHLLSPDS
RPKFTRAILQSGVPNGPWRTVSFDEARRRAIKLGRLVGCPDGNDTDLIDCLRSKQPQDLI
DQEWLVLPFSGLFRFSFVPVIDGVVFPDTPEAMLNSGNFKDTQILLGVNQNEGSYFLIYG
APGFSKDNESLITREDFLQGVKMSVPHANEIGLEAVILQYTDWMDEDNPIKNREAMDDIV
GDHNVVCPLQHFAKMYAQYSILQGQTGTASQGNLGWGNSGSASNSGNSQVSVYLYMFDHR
ASNLVWPEWMGVIHGYEIEFVFGLPLEKRLNYTLEEEKLSRRMMKYWANFARTGNPNINV
DGSIDSRRRWPVFTSTEQKHVGLNTDSLKVHKGLKSQFCALWNRFLPRLLNVTENIDDAE
RQWKAEFHRWSSYMMHWKNQFDHYSKQERCTNL
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BDBM50335637 |
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n/a |
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Name | BDBM50335637 |
Synonyms: | CHEMBL1651810 | N-[2-({2-[(2-Aminoethyl)amino]ethyl}amino)ethyl]-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide |
Type | Small organic molecule |
Emp. Form. | C16H23N5O3 |
Mol. Mass. | 333.3855 |
SMILES | NCCNCCNCCNC(=O)c1c(O)c2ccccc2[nH]c1=O |
Structure |
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