Compile Data Set for Download or QSAR

Found 39 hits with Last Name = 'kenley' and Initial = 'ra'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025238 (CHEMBL71740 | N-Hydroxy-3-octyl-[1,2,4]oxadiazole-...) Show SMILES CCCCCCCCc1noc(n1)C(SCCN(CC)CC)N=O Show InChI InChI=1S/C17H32N4O2S/c1-4-7-8-9-10-11-12-15-18-16(23-20-15)17(19-22)24-14-13-21(5-2)6-3/h17H,4-14H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the concentration required for reversible inhibition of human acetylcholinesterase .				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025251 (CHEMBL302946 | N-Hydroxy-3-naphthalen-1-yl-[1,2,4]...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)-c1cccc2ccccc12 Show InChI InChI=1S/C19H22N4O2S/c1-3-23(4-2)12-13-26-19(21-24)18-20-17(22-25-18)16-11-7-9-14-8-5-6-10-15(14)16/h5-11,19H,3-4,12-13H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025238 (CHEMBL71740 | N-Hydroxy-3-octyl-[1,2,4]oxadiazole-...) Show SMILES CCCCCCCCc1noc(n1)C(SCCN(CC)CC)N=O Show InChI InChI=1S/C17H32N4O2S/c1-4-7-8-9-10-11-12-15-18-16(23-20-15)17(19-22)24-14-13-21(5-2)6-3/h17H,4-14H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the concentration required for reversible inhibition of eel acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025242 (CHEMBL20339 | CHEMBL2079594 | N-Hydroxy-3-phenyl-[...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C15H20N4O2S/c1-3-19(4-2)10-11-22-15(17-20)14-16-13(18-21-14)12-8-6-5-7-9-12/h5-9,15H,3-4,10-11H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025242 (CHEMBL20339 | CHEMBL2079594 | N-Hydroxy-3-phenyl-[...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C15H20N4O2S/c1-3-19(4-2)10-11-22-15(17-20)14-16-13(18-21-14)12-8-6-5-7-9-12/h5-9,15H,3-4,10-11H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025239 (3-Benzyl-N-hydroxy-[1,2,4]oxadiazole-5-carboximido...) Show SMILES CCN(CC)CCSC(N=O)c1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C16H22N4O2S/c1-3-20(4-2)10-11-23-16(18-21)15-17-14(19-22-15)12-13-8-6-5-7-9-13/h5-9,16H,3-4,10-12H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025239 (3-Benzyl-N-hydroxy-[1,2,4]oxadiazole-5-carboximido...) Show SMILES CCN(CC)CCSC(N=O)c1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C16H22N4O2S/c1-3-20(4-2)10-11-23-16(18-21)15-17-14(19-22-15)12-13-8-6-5-7-9-13/h5-9,16H,3-4,10-12H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025247 (3-tert-Butyl-N-hydroxy-[1,2,4]oxadiazole-5-carboxi...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)C(C)(C)C Show InChI InChI=1S/C13H24N4O2S/c1-6-17(7-2)8-9-20-11(15-18)10-14-12(16-19-10)13(3,4)5/h11H,6-9H2,1-5H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025247 (3-tert-Butyl-N-hydroxy-[1,2,4]oxadiazole-5-carboxi...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)C(C)(C)C Show InChI InChI=1S/C13H24N4O2S/c1-6-17(7-2)8-9-20-11(15-18)10-14-12(16-19-10)13(3,4)5/h11H,6-9H2,1-5H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025252 (CHEMBL19557 | N-Hydroxy-3-methyl-[1,2,4]oxadiazole...) Show SMILES CCN(CC)CCSC(N=O)c1nc(C)no1 Show InChI InChI=1S/C10H18N4O2S/c1-4-14(5-2)6-7-17-10(12-15)9-11-8(3)13-16-9/h10H,4-7H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025252 (CHEMBL19557 | N-Hydroxy-3-methyl-[1,2,4]oxadiazole...) Show SMILES CCN(CC)CCSC(N=O)c1nc(C)no1 Show InChI InChI=1S/C10H18N4O2S/c1-4-14(5-2)6-7-17-10(12-15)9-11-8(3)13-16-9/h10H,4-7H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025242 (CHEMBL20339 | CHEMBL2079594 | N-Hydroxy-3-phenyl-[...) Show SMILES CCN(CC)CCSC(N=O)c1nc(no1)-c1ccccc1 Show InChI InChI=1S/C15H20N4O2S/c1-3-19(4-2)10-11-22-15(17-20)14-16-13(18-21-14)12-8-6-5-7-9-12/h5-9,15H,3-4,10-11H2,1-2H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025253 (CHEMBL69059 | N-(2-Diethylamino-ethyl)-N'-hydroxy-...) Show SMILES CCN(CC)CCNC(=NO)c1nc(no1)-c1ccccc1 |w:9.9| Show InChI InChI=1S/C15H21N5O2/c1-3-20(4-2)11-10-16-14(18-21)15-17-13(19-22-15)12-8-6-5-7-9-12/h5-9,21H,3-4,10-11H2,1-2H3,(H,16,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	2.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50020514 (2-(Hydroxyimino-methyl)-1-methoxymethyl-3-methyl-3...) Show SMILES COC[n+]1ccn(C)c1CN=O Show InChI InChI=1S/C7H12N3O2/c1-9-3-4-10(6-12-2)7(9)5-8-11/h3-4H,5-6H2,1-2H3/q+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Concentration of the HOX that inhibits 50% of AChE (Acetylcholinesterase) activity				J Med Chem 27: 1431-8 (1984) BindingDB Entry DOI: 10.7270/Q2TH8KP8
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025241 (3-Thiophen-2-yl-[1,2,4]oxadiazole-5-carbaldehyde o...) Show SMILES O=NCc1nc(no1)-c1cccs1 Show InChI InChI=1S/C7H5N3O2S/c11-8-4-6-9-7(10-12-6)5-2-1-3-13-5/h1-3H,4H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>3.60E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50011780 (2-[(E)-(hydroxyimino)methyl]-1-methylpyridinium ch...) Show SMILES C[n+]1ccccc1CN=O Show InChI InChI=1S/C7H9N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-5H,6H2,1H3/q+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025246 (2-[2-(4-Carbamoyl-pyridin-1-yloxy)-ethyl]-6-(hydro...) Show SMILES C[n+]1c(CCO[n+]2ccc(cc2)C(N)=O)cccc1CN=O Show InChI InChI=1S/C15H17N4O3/c1-18-13(3-2-4-14(18)11-17-21)7-10-22-19-8-5-12(6-9-19)15(16)20/h2-6,8-9H,7,10-11H2,1H3,(H-,16,20)/q+1/p+1	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	4.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025241 (3-Thiophen-2-yl-[1,2,4]oxadiazole-5-carbaldehyde o...) Show SMILES O=NCc1nc(no1)-c1cccs1 Show InChI InChI=1S/C7H5N3O2S/c11-8-4-6-9-7(10-12-6)5-2-1-3-13-5/h1-3H,4H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>5.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025253 (CHEMBL69059 | N-(2-Diethylamino-ethyl)-N'-hydroxy-...) Show SMILES CCN(CC)CCNC(=NO)c1nc(no1)-c1ccccc1 |w:9.9| Show InChI InChI=1S/C15H21N5O2/c1-3-20(4-2)11-10-16-14(18-21)15-17-13(19-22-15)12-8-6-5-7-9-12/h5-9,21H,3-4,10-11H2,1-2H3,(H,16,18)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	8.90E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025244 (3-Phenyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(no1)-c1ccccc1 Show InChI InChI=1S/C9H7N3O2/c13-10-6-8-11-9(12-14-8)7-4-2-1-3-5-7/h1-5H,6H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025240 (3-Octyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | C...) Show SMILES CCCCCCCCc1noc(CN=O)n1 Show InChI InChI=1S/C11H19N3O2/c1-2-3-4-5-6-7-8-10-13-11(9-12-15)16-14-10/h2-9H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025243 (3-tert-Butyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES CC(C)(C)c1noc(CN=O)n1 Show InChI InChI=1S/C7H11N3O2/c1-7(2,3)6-9-5(4-8-11)12-10-6/h4H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025244 (3-Phenyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(no1)-c1ccccc1 Show InChI InChI=1S/C9H7N3O2/c13-10-6-8-11-9(12-14-8)7-4-2-1-3-5-7/h1-5H,6H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025245 (3-Pyridin-4-yl-[1,2,4]oxadiazole-5-carbaldehyde ox...) Show SMILES O=NCc1nc(no1)-c1ccncc1 Show InChI InChI=1S/C8H6N4O2/c13-10-5-7-11-8(12-14-7)6-1-3-9-4-2-6/h1-4H,5H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025249 ((E)-3-Methyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES Cc1noc(CN=O)n1 Show InChI InChI=1S/C4H5N3O2/c1-3-6-4(2-5-8)9-7-3/h2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the concentration required for reversible inhibition of eel acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50011780 (2-[(E)-(hydroxyimino)methyl]-1-methylpyridinium ch...) Show SMILES C[n+]1ccccc1CN=O Show InChI InChI=1S/C7H9N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-5H,6H2,1H3/q+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025250 (3-Naphthalen-1-yl-[1,2,4]oxadiazole-5-carbaldehyde...) Show SMILES O=NCc1nc(no1)-c1cccc2ccccc12 Show InChI InChI=1S/C13H9N3O2/c17-14-8-12-15-13(16-18-12)11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025248 (3-Benzyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C10H9N3O2/c14-11-7-10-12-9(13-15-10)6-8-4-2-1-3-5-8/h1-5H,6-7H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025246 (2-[2-(4-Carbamoyl-pyridin-1-yloxy)-ethyl]-6-(hydro...) Show SMILES C[n+]1c(CCO[n+]2ccc(cc2)C(N)=O)cccc1CN=O Show InChI InChI=1S/C15H17N4O3/c1-18-13(3-2-4-14(18)11-17-21)7-10-22-19-8-5-12(6-9-19)15(16)20/h2-6,8-9H,7,10-11H2,1H3,(H-,16,20)/q+1/p+1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025248 (3-Benzyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(Cc2ccccc2)no1 Show InChI InChI=1S/C10H9N3O2/c14-11-7-10-12-9(13-15-10)6-8-4-2-1-3-5-8/h1-5H,6-7H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025249 ((E)-3-Methyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES Cc1noc(CN=O)n1 Show InChI InChI=1S/C4H5N3O2/c1-3-6-4(2-5-8)9-7-3/h2H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025240 (3-Octyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | C...) Show SMILES CCCCCCCCc1noc(CN=O)n1 Show InChI InChI=1S/C11H19N3O2/c1-2-3-4-5-6-7-8-10-13-11(9-12-15)16-14-10/h2-9H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025243 (3-tert-Butyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES CC(C)(C)c1noc(CN=O)n1 Show InChI InChI=1S/C7H11N3O2/c1-7(2,3)6-9-5(4-8-11)12-10-6/h4H2,1-3H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025249 ((E)-3-Methyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES Cc1noc(CN=O)n1 Show InChI InChI=1S/C4H5N3O2/c1-3-6-4(2-5-8)9-7-3/h2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025249 ((E)-3-Methyl-[1,2,4]oxadiazole-5-carbaldehyde oxim...) Show SMILES Cc1noc(CN=O)n1 Show InChI InChI=1S/C4H5N3O2/c1-3-6-4(2-5-8)9-7-3/h2H2,1H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the concentration required for reversible inhibition of human acetylcholinesterase .				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50025244 (3-Phenyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(no1)-c1ccccc1 Show InChI InChI=1S/C9H7N3O2/c13-10-6-8-11-9(12-14-8)7-4-2-1-3-5-7/h1-5H,6H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Reactivation of human acetylcholinesterase				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50405148 (CHEMBL280945) Show SMILES Cc1nsc(CN=O)n1 Show InChI InChI=1S/C4H5N3OS/c1-3-6-4(2-5-8)9-7-3/h2H2,1H3	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	8.0	n/a
TBA Curated by ChEMBL					Assay Description Concentration at 2 uM that inhibits 50%of acetylcholinesterase activity evaluated in vitro at a pH of 8 in the presence of 7.5x10E-4 acetylthiocholin...				J Med Chem 27: 1201-11 (1984) BindingDB Entry DOI: 10.7270/Q2XK8GRJ
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025250 (3-Naphthalen-1-yl-[1,2,4]oxadiazole-5-carbaldehyde...) Show SMILES O=NCc1nc(no1)-c1cccc2ccccc12 Show InChI InChI=1S/C13H9N3O2/c17-14-8-12-15-13(16-18-12)11-7-3-5-9-4-1-2-6-10(9)11/h1-7H,8H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair
Acetylcholinesterase (Electrophorus electricus (Electric eel))	BDBM50025244 (3-Phenyl-[1,2,4]oxadiazole-5-carbaldehyde oxime | ...) Show SMILES O=NCc1nc(no1)-c1ccccc1 Show InChI InChI=1S/C9H7N3O2/c13-10-6-8-11-9(12-14-8)7-4-2-1-3-5-7/h1-5H,6H2	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro reversible inhibition of eel acetylcholinesterase.				J Med Chem 29: 2174-83 (1986) BindingDB Entry DOI: 10.7270/Q2VQ31QK
					More data for this Ligand-Target Pair