BindingDB PrimarySearch

BDBM50240416 CHEMBL23838::O,O-diethyl O-p-nitrophenyl phosphate::diethyl 4-nitrophenyl phosphate::diethyl p-nitrophenyl phosphate::diethyl paraoxon::ethyl paraoxon::p-nitrophenyl diethyl phosphate::paraoxon::phosphacol::phosphoric acid diethyl 4-nitrophenyl ester

SMILES: CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=WYMSBXTXOHUIGT-UHFFFAOYSA-N

Data: 10 KI 11 IC50 1 Kd

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 22 hits for monomerid = 50240416
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Carboxylic ester hydrolase (Schizaphis graminum)	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	MMDB NCI pathway Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	0.720	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kansas State University Curated by ChEMBL					Assay Description Inhibition of AChE in organophosphate-resistant clone of Schizaphis graminum OR2 adult or last-instar nymphs homogenates assessed as bimolecular rate...				J Agric Food Chem 48: 4717-22 (2000) Article DOI: 10.1021/jf000548p BindingDB Entry DOI: 10.7270/Q2C82D66
Kansas State University Curated by ChEMBL					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Schizaphis graminum)	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	MMDB NCI pathway Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	0.810	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kansas State University Curated by ChEMBL					Assay Description Inhibition of AChE in organophosphate-resistant clone of Schizaphis graminum OR1 adult or last-instar nymphs homogenates assessed as bimolecular rate...				J Agric Food Chem 48: 4717-22 (2000) Article DOI: 10.1021/jf000548p BindingDB Entry DOI: 10.7270/Q2C82D66
Kansas State University Curated by ChEMBL					More data for this Ligand-Target Pair
Carboxylic ester hydrolase (Schizaphis graminum)	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	MMDB NCI pathway Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	1.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kansas State University Curated by ChEMBL					Assay Description Inhibition of AChE in organophosphate-susceptible clone of Schizaphis graminum OSS adult or last-instar nymphs homogenates assessed as bimolecular ra...				J Agric Food Chem 48: 4717-22 (2000) Article DOI: 10.1021/jf000548p BindingDB Entry DOI: 10.7270/Q2C82D66
Kansas State University Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) (Rattus norvegicus (rat))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	1.60	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
The University of Montana Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	2	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
The University of Montana Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	3	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 recombinant AChE				Bioorg Med Chem Lett 20: 1194-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.007 BindingDB Entry DOI: 10.7270/Q27W6G0T
The University of Montana Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase and butyrylcholinesterase (AChE and BChE) (Rattus norvegicus (rat))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	3.40	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 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
The University of Montana Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	4	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 mouse recombinant AChE				Bioorg Med Chem Lett 20: 1194-7 (2010) Article DOI: 10.1016/j.bmcl.2009.12.007 BindingDB Entry DOI: 10.7270/Q27W6G0T
The University of Montana Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor DM1 (Drosophila melanogaster)	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of [3H]AF-DX 384 from Drosophila melanogaster mAChR by scintillation counting				J Agric Food Chem 55: 2276-81 (2007) Article DOI: 10.1021/jf0631934 BindingDB Entry DOI: 10.7270/Q2WQ06PC
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Muscarinic acetylcholine receptor DM1 (Drosophila melanogaster)	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of [3H]QNB from Drosophila melanogaster mAChR by scintillation counting				J Agric Food Chem 55: 2276-81 (2007) Article DOI: 10.1021/jf0631934 BindingDB Entry DOI: 10.7270/Q2WQ06PC
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Inhibition of human AChE using p-nitrophenyl acetate as substrate measured for 30 secs by spectrophotometric analysis				Bioorg Med Chem 25: 3053-3058 (2017) Article DOI: 10.1016/j.bmc.2017.03.058 BindingDB Entry DOI: 10.7270/Q2H70J09
University of Missouri St. Louis Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	n/a	1.70E+5	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Binding affinity to Electric eel AChE using acetylthiocholine as substrate measured for 30 secs by Ellman's method				Bioorg Med Chem 25: 3053-3058 (2017) Article DOI: 10.1016/j.bmc.2017.03.058 BindingDB Entry DOI: 10.7270/Q2H70J09
University of Missouri St. Louis Curated by ChEMBL					More data for this Ligand-Target Pair
Cholinesterases (Homo sapiens (Human))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
University of Missouri St. Louis Curated by ChEMBL					Assay Description Inhibition of human BChE using butyrylthiocholine as substrate measured for 30 secs by Ellman's method				Bioorg Med Chem 25: 3053-3058 (2017) Article DOI: 10.1016/j.bmc.2017.03.058 BindingDB Entry DOI: 10.7270/Q2H70J09
University of Missouri St. Louis Curated by ChEMBL					More data for this Ligand-Target Pair
Carbonic Anhydrase XIII (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of esterase activity of mouse carbonic anhydrase 13 by CO2 hydration method				Bioorg Med Chem Lett 20: 6208-12 (2010) Article DOI: 10.1016/j.bmcl.2010.08.110 BindingDB Entry DOI: 10.7270/Q24X581T
Università degli Studi di Firenze Curated by ChEMBL					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	59	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of esterase activity of human carbonic anhydrase 2 by CO2 hydration method				Bioorg Med Chem Lett 20: 6208-12 (2010) Article DOI: 10.1016/j.bmcl.2010.08.110 BindingDB Entry DOI: 10.7270/Q24X581T
Università degli Studi di Firenze Curated by ChEMBL					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	338	n/a	n/a	n/a	n/a	n/a	n/a
Università degli Studi di Firenze Curated by ChEMBL					Assay Description Inhibition of esterase activity of human carbonic anhydrase 1 by CO2 hydration method				Bioorg Med Chem Lett 20: 6208-12 (2010) Article DOI: 10.1016/j.bmcl.2010.08.110 BindingDB Entry DOI: 10.7270/Q24X581T
Università degli Studi di Firenze Curated by ChEMBL					More data for this Ligand-Target Pair
Acetylcholinesterase (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of acetylcholine from AChE in Swiss Webster mouse brain after 5 mins				Nat Chem Biol 4: 373-8 (2008) Article DOI: 10.1038/nchembio.86 BindingDB Entry DOI: 10.7270/Q2SX6DF4
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Anandamide amidohydrolase (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of [3H]anandamide from FAAH in Swiss Webster mouse brain after 5 mins				Nat Chem Biol 4: 373-8 (2008) Article DOI: 10.1038/nchembio.86 BindingDB Entry DOI: 10.7270/Q2SX6DF4
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Monoglyceride Lipase (MGL) (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of 2-arachidonylglycerol from MAGL in Swiss Webster mouse brain after 5 mins				Nat Chem Biol 4: 373-8 (2008) Article DOI: 10.1038/nchembio.86 BindingDB Entry DOI: 10.7270/Q2SX6DF4
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Mus musculus (Mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Displacement of [3H]CP55940 from CB1 receptor in mouse brain				Bioorg Med Chem Lett 18: 5875-8 (2008) Article DOI: 10.1016/j.bmcl.2008.08.007 BindingDB Entry DOI: 10.7270/Q2S75G4N
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Monoglyceride Lipase (MGL) (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of MAGL-mediated 2-arachidonoylglycerol hydrolysis in mouse brain				Bioorg Med Chem Lett 18: 5875-8 (2008) Article DOI: 10.1016/j.bmcl.2008.08.007 BindingDB Entry DOI: 10.7270/Q2S75G4N
University of California Curated by ChEMBL					More data for this Ligand-Target Pair
Anandamide amidohydrolase (Mus musculus (mouse))	BDBM50240416 (CHEMBL23838 \| O,O-diethyl O-p-nitrophenyl phosphat...) Show SMILES CCOP(=O)(OCC)Oc1ccc(cc1)[N+]([O-])=O Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Inhibition of FAAH-mediated [3H]anadamide hydrolysis in mouse brain				Bioorg Med Chem Lett 18: 5875-8 (2008) Article DOI: 10.1016/j.bmcl.2008.08.007 BindingDB Entry DOI: 10.7270/Q2S75G4N
University of California Curated by ChEMBL					More data for this Ligand-Target Pair