BindingDB logo
myBDB logout

null

SMILES: COC(=O)C1[C@@H]2Cc3c([C@@H]4C[C@@H]1\C(CN24)=C\C)n(C)c1ccc(OC)cc31

InChI Key: InChIKey=ZGOAABQSDQXUOB-SKKBYJJNSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50292339   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Acetylcholinesterase


(Electrophorus electricus (Electric eel))		BDBM50292339
PNG
(10-methyl-N1-methylpericylivine | CHEMBL463771)
Show SMILES COC(=O)C1[C@@H]2Cc3c([C@@H]4C[C@@H]1\C(CN24)=C\C)n(C)c1ccc(OC)cc31 |r,TLB:15:12:9.10:5.4,THB:13:14:8.7.6:10.11.4|
Show InChI InChI=1S/C22H26N2O3/c1-5-12-11-24-18-10-16-15-8-13(26-3)6-7-17(15)23(2)21(16)19(24)9-14(12)20(18)22(25)27-4/h5-8,14,18-20H,9-11H2,1-4H3/b12-5+/t14-,18+,19+,20?/m1/s1
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
n/an/a 1.35E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE

J Nat Prod 59: 890-893 (1996)


Article DOI: 10.1021/np960070c
BindingDB Entry DOI: 10.7270/Q2KH0NBD
More data for this
Ligand-Target Pair