BDBM50146853 3-{2-[5-(5-Methyl-2,4-dioxo-3,4-dihydro-2H-pyrimidin-1-yl)-2,5-dihydro-furan-2-ylmethoxy]-2-oxo-4H-2lambda*5*-benzo[1,3,2]dioxaphosphinin-6-yl}-propionic acid tert-butyl ester::CHEMBL97159

SMILES: Cc1cn(C2OC(COP3(=O)OCc4cc(CCC(=O)OC(C)(C)C)ccc4O3)C=C2)c(=O)[nH]c1=O

InChI Key: InChIKey=QHESSMRARDPMJF-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 = 50146853   

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))	BDBM50146853 (3-{2-[5-(5-Methyl-2,4-dioxo-3,4-dihydro-2H-pyrimid...) Show SMILES Cc1cn(C2OC(COP3(=O)OCc4cc(CCC(=O)OC(C)(C)C)ccc4O3)C=C2)c(=O)[nH]c1=O |c:31| Show InChI InChI=1S/C24H29N2O9P/c1-15-12-26(23(29)25-22(15)28)20-9-7-18(33-20)14-32-36(30)31-13-17-11-16(5-8-19(17)35-36)6-10-21(27)34-24(2,3)4/h5,7-9,11-12,18,20H,6,10,13-14H2,1-4H3,(H,25,28,29)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Hamburg Curated by ChEMBL					Assay Description Inhibitory activity towards human butyrylcholinesterase				J Med Chem 47: 2839-52 (2004) Article DOI: 10.1021/jm031032a BindingDB Entry DOI: 10.7270/Q2P84CN5
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50146853 (3-{2-[5-(5-Methyl-2,4-dioxo-3,4-dihydro-2H-pyrimid...) Show SMILES Cc1cn(C2OC(COP3(=O)OCc4cc(CCC(=O)OC(C)(C)C)ccc4O3)C=C2)c(=O)[nH]c1=O |c:31| Show InChI InChI=1S/C24H29N2O9P/c1-15-12-26(23(29)25-22(15)28)20-9-7-18(33-20)14-32-36(30)31-13-17-11-16(5-8-19(17)35-36)6-10-21(27)34-24(2,3)4/h5,7-9,11-12,18,20H,6,10,13-14H2,1-4H3,(H,25,28,29)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Hamburg Curated by ChEMBL					Assay Description Inhibitory activity towards Electrophorus electricus acetylcholinesterase				J Med Chem 47: 2839-52 (2004) Article DOI: 10.1021/jm031032a BindingDB Entry DOI: 10.7270/Q2P84CN5
					More data for this Ligand-Target Pair