BDBM50242975 CHEMBL4069096

SMILES: CCc1ccc(cc1)N1C(=O)C2CN(C)C3(C2C1=O)C(=O)c1ccccc1C3=O

InChI Key: InChIKey=BMWMIFFFCMWDDW-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50242975   

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
Cholinesterases (Homo sapiens (Human))	BDBM50242975 (CHEMBL4069096) Show SMILES CCc1ccc(cc1)N1C(=O)C2CN(C)C3(C2C1=O)C(=O)c1ccccc1C3=O Show InChI InChI=1S/C23H20N2O4/c1-3-13-8-10-14(11-9-13)25-21(28)17-12-24(2)23(18(17)22(25)29)19(26)15-6-4-5-7-16(15)20(23)27/h4-11,17-18H,3,12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
Madurai Kamaraj University Curated by ChEMBL					Assay Description Inhibition of AChE (unknown origin) using acetylcholine as substrate preincubated for 15 mins followed by substrate addition measured every minute by...				Bioorg Med Chem Lett 27: 3071-3075 (2017) Article DOI: 10.1016/j.bmcl.2017.05.050 BindingDB Entry DOI: 10.7270/Q2BG2RDS
					More data for this Ligand-Target Pair