BDBM50434521 CHEMBL2385770

SMILES: Clc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Cl)cc2)cc1

InChI Key: InChIKey=KYRHFJFGKUVOHZ-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 = 50434521   

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))	BDBM50434521 (CHEMBL2385770) Show SMILES Clc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Cl)cc2)cc1 |w:5.4,t:15| Show InChI InChI=1S/C20H17Cl2N3O/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.68E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of electric eel AChE using acetylcholine iodide as substrate incubated for 15 mins prior to substrate addition measured after 30 mins by E...				Bioorg Med Chem 21: 3022-31 (2013) Article DOI: 10.1016/j.bmc.2013.03.058 BindingDB Entry DOI: 10.7270/Q2V40WK4
					More data for this Ligand-Target Pair
Butyrylcholinesterase (BuChE) (Equus caballus (Horse))	BDBM50434521 (CHEMBL2385770) Show SMILES Clc1ccc(C=C2CNCC3C(NC(=O)N=C23)c2ccc(Cl)cc2)cc1 |w:5.4,t:15| Show InChI InChI=1S/C20H17Cl2N3O/c21-15-5-1-12(2-6-15)9-14-10-23-11-17-18(24-20(26)25-19(14)17)13-3-7-16(22)8-4-13/h1-9,17-18,23H,10-11H2,(H,24,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.67E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universiti Sains Malaysia Curated by ChEMBL					Assay Description Inhibition of equine serum BuChE using S-butyrylthiocholine chloride as substrate incubated for 15 mins prior to substrate addition measured after 30...				Bioorg Med Chem 21: 3022-31 (2013) Article DOI: 10.1016/j.bmc.2013.03.058 BindingDB Entry DOI: 10.7270/Q2V40WK4
					More data for this Ligand-Target Pair