BDBM50389628 CHEMBL2069646::CHEMBL2069777

SMILES: OC(=O)c1ccc(cc1)-n1c(O)c2ON([C@H](c2c1O)c1ccccc1O)c1ccccc1

InChI Key: InChIKey=AEUGEDYPAHZHGE-FQEVSTJZSA-N

Data: 2 IC50

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 2 hits for monomerid = 50389628   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50389628 (CHEMBL2069646 | CHEMBL2069777) Show SMILES OC(=O)c1ccc(cc1)-n1c(O)c2ON([C@H](c2c1O)c1ccccc1O)c1ccccc1 |r| Show InChI InChI=1S/C24H18N2O6/c27-18-9-5-4-8-17(18)20-19-21(32-26(20)16-6-2-1-3-7-16)23(29)25(22(19)28)15-12-10-14(11-13-15)24(30)31/h1-13,20,27-29H,(H,30,31)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23.9	n/a	n/a	n/a	n/a	n/a	n/a
Punjabi University Curated by ChEMBL					Assay Description Inhibition of AChE activity in rat brain homogenate using acetylthiocholine as substrate by Ellman's method				Bioorg Med Chem 20: 521-30 (2011) Article DOI: 10.1016/j.bmc.2011.05.027 BindingDB Entry DOI: 10.7270/Q22B903F
					More data for this Ligand-Target Pair
Acetylcholinesterase (Rattus norvegicus (rat))	BDBM50389628 (CHEMBL2069646 | CHEMBL2069777) Show SMILES OC(=O)c1ccc(cc1)-n1c(O)c2ON([C@H](c2c1O)c1ccccc1O)c1ccccc1 |r| Show InChI InChI=1S/C24H18N2O6/c27-18-9-5-4-8-17(18)20-19-21(32-26(20)16-6-2-1-3-7-16)23(29)25(22(19)28)15-12-10-14(11-13-15)24(30)31/h1-13,20,27-29H,(H,30,31)/t20-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	24.8	n/a	n/a	n/a	n/a	n/a	n/a
Punjabi University Curated by ChEMBL					Assay Description Inhibition of AChE activity in rat brain homogenate using acetylthiocholine as substrate by Ellman's method				Bioorg Med Chem 20: 521-30 (2011) Article DOI: 10.1016/j.bmc.2011.05.027 BindingDB Entry DOI: 10.7270/Q22B903F
					More data for this Ligand-Target Pair