null

SMILES: COC(=O)C(OP(C)(=O)OCC#C)C(F)(F)F

InChI Key: InChIKey=OEFVRNNHTUIANX-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50358312   

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 (Homo sapiens (Human))	BDBM50358312 (CHEMBL1922541) Show SMILES COC(=O)C(OP(C)(=O)OCC#C)C(F)(F)F Show InChI InChI=1S/C8H10F3O5P/c1-4-5-15-17(3,13)16-6(7(12)14-2)8(9,10)11/h1,6H,5H2,2-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.36E+4	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Inhibition of human erythrocyte AChE incubated for 12 mins before addition of acetylthiocholine iodide substrate by spectrophotometric analysis				Bioorg Med Chem Lett 21: 7216-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.030 BindingDB Entry DOI: 10.7270/Q2W66M65
					More data for this Ligand-Target Pair
Liver carboxylesterase (Sus scrofa)	BDBM50358312 (CHEMBL1922541) Show SMILES COC(=O)C(OP(C)(=O)OCC#C)C(F)(F)F Show InChI InChI=1S/C8H10F3O5P/c1-4-5-15-17(3,13)16-6(7(12)14-2)8(9,10)11/h1,6H,5H2,2-3H3	PDB KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.06E+3	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Inhibition of pig liver carboxylesterase using p-nitrophenyl acetate as substrate by spectrophotometric analysis				Bioorg Med Chem Lett 21: 7216-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.030 BindingDB Entry DOI: 10.7270/Q2W66M65
					More data for this Ligand-Target Pair
Cholinesterase (Equus caballus (Horse))	BDBM50358312 (CHEMBL1922541) Show SMILES COC(=O)C(OP(C)(=O)OCC#C)C(F)(F)F Show InChI InChI=1S/C8H10F3O5P/c1-4-5-15-17(3,13)16-6(7(12)14-2)8(9,10)11/h1,6H,5H2,2-3H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.89E+4	n/a	n/a	n/a	n/a	n/a	n/a
Moscow State University Curated by ChEMBL					Assay Description Inhibition of horse serum BChE incubated for 12 mins before addition of butyrylcholine iodide substrate by spectrophotometric analysis				Bioorg Med Chem Lett 21: 7216-8 (2011) Article DOI: 10.1016/j.bmcl.2011.09.030 BindingDB Entry DOI: 10.7270/Q2W66M65
					More data for this Ligand-Target Pair