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Target
Acetylcholinesterase
Ligand
BDBM50092530
Substrate
n/a
Meas. Tech.
ChEMBL_1500860 (CHEMBL3588424)
IC50
9980±n/a nM
Citation
 Nguyen, VT; To, DC; Tran, MH; Oh, SH; Kim, JA; Ali, MY; Woo, MH; Choi, JS; Min, BS Isolation of cholinesterase andß-secretase 1 inhibiting compounds from Lycopodiella cernua. Bioorg Med Chem 23:3126-34 (2015) [PubMed]  Article 
Target
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:
MRPPQCLLHTPSLASPLLLLLLWLLGGGVGAEGREDAELLVTVRGGRLRGIRLKTPGGPVSAFLGIPFAEPPMGPRRFLPPEPKQPWSGVVDATTFQSVCYQYVDTLYPGFEGTEMWNPNRELSEDCLYLNVWTPYPRPTSPTPVLVWIYGGGFYSGASSLDVYDGRFLVQAERTVLVSMNYRVGAFGFLALPGSREAPGNVGLLDQRLALQWVQENVAAFGGDPTSVTLFGESAGAASVGMHLLSPPSRGLFHRAVLQSGAPNGPWATVGMGEARRRATQLAHLVGCPPGGTGGNDTELVACLRTRPAQVLVNHEWHVLPQESVFRFSFVPVVDGDFLSDTPEALINAGDFHGLQVLVGVVKDEGSYFLVYGAPGFSKDNESLISRAEFLAGVRVGVPQVSDLAAEAVVLHYTDWLHPEDPARLREALSDVVGDHNVVCPVAQLAGRLAAQGARVYAYVFEHRASTLSWPLWMGVPHGYEIEFIFGIPLDPSRNYTAEEKIFAQRLMRYWANFARTGDPNEPRDPKAPQWPPYTAGAQQYVSLDLRPLEVRRGLRAQACAFWNRFLPKLLSATDTLDEAERQWKAEFHRWSSYMVHWKNQFDHYSKQDRCSDL
  
Inhibitor
Name:
BDBM50092530
Synonyms:
CHEMBL3586198
Type:
Small organic molecule
Emp. Form.:
C38H56O9
Mol. Mass.:
656.8458
SMILES:
[H][C@@]12C[C@H](O)[C@@]3(O)C[C@]4(C)CC[C@]5([H])[C@](C)(CC[C@H](OC(=O)c6ccc(OC)c(O)c6)[C@]5(C)C(O)=O)[C@@]4([H])CC[C@]3([H])[C@@]1(C)CC[C@@H](O)C2(C)C |r|
Structure:
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