BDBM50140174 CHEMBL2403495

SMILES: Fc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1

InChI Key: InChIKey=MKUBNVMTENZGRX-UHFFFAOYSA-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 = 50140174   

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 (Electrophorus electricus (Electric eel))	BDBM50140174 (CHEMBL2403495) Show SMILES Fc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 Show InChI InChI=1S/C17H13FN2OS/c18-14-8-6-12(7-9-14)10-16(21)20-17-19-15(11-22-17)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,19,20,21)	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
Linyi People's Hospital Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylthiocholine iodide as substrate preincubated for 15 mins followed by substrate addition measured after 15...				Bioorg Med Chem Lett 26: 747-50 (2016) BindingDB Entry DOI: 10.7270/Q2GT5Q18
					More data for this Ligand-Target Pair
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50140174 (CHEMBL2403495) Show SMILES Fc1ccc(CC(=O)Nc2nc(cs2)-c2ccccc2)cc1 Show InChI InChI=1S/C17H13FN2OS/c18-14-8-6-12(7-9-14)10-16(21)20-17-19-15(11-22-17)13-4-2-1-3-5-13/h1-9,11H,10H2,(H,19,20,21)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
Linyi People's Hospital Curated by ChEMBL					Assay Description Inhibition of equine serum BChE using acetylthiocholine iodide as substrate preincubated for 15 mins followed by substrate addition measured after 15...				Bioorg Med Chem Lett 26: 747-50 (2016) BindingDB Entry DOI: 10.7270/Q2GT5Q18
					More data for this Ligand-Target Pair