BDBM50490822 2-Fluoroethyl 4-Nitrophenyl Methylphosphonate::CHEMBL2348365

SMILES: CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=BBDQLOUKNUVPFF-UHFFFAOYSA-N

Data: 6 KI

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 6 hits for monomerid = 50490822   

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))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of human recombinant AChE by time-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by time-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	5.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of electric eel AChE by concentration-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair
Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) (Rattus norvegicus (rat))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of rat brain AChE by concentration-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair
Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) (Rattus norvegicus (rat))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	6.20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of rat brain AChE by time-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50490822 (2-Fluoroethyl 4-Nitrophenyl Methylphosphonate | CH...) Show SMILES CP(=O)(OCCF)Oc1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C9H11FNO5P/c1-17(14,15-7-6-10)16-9-4-2-8(3-5-9)11(12)13/h2-5H,6-7H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	7.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
The University of Montana Curated by ChEMBL					Assay Description Inhibition of human recombinant AChE by concentration-dependent inhibition assay				Bioorg Med Chem Lett 23: 2048-51 (2013) Article DOI: 10.1016/j.bmcl.2013.02.010 BindingDB Entry DOI: 10.7270/Q2VH5RSV
					More data for this Ligand-Target Pair