BDBM50146878 2-(6-Amino-purin-9-yl)-5-(8-methyl-2-oxo-4H-2lambda*5*-benzo[1,3,2]dioxaphosphinin-2-yloxymethyl)-tetrahydro-furan-3-ol::CHEMBL97145

SMILES: Cc1cccc2COP(=O)(OCC3CC(O)C(O3)n3cnc4c(N)ncnc34)Oc12

InChI Key: InChIKey=ANQWWUWQNXMQBV-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 = 50146878   

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))	BDBM50146878 (2-(6-Amino-purin-9-yl)-5-(8-methyl-2-oxo-4H-2lambd...) Show SMILES Cc1cccc2COP(=O)(OCC3CC(O)C(O3)n3cnc4c(N)ncnc34)Oc12 Show InChI InChI=1S/C18H20N5O6P/c1-10-3-2-4-11-6-26-30(25,29-15(10)11)27-7-12-5-13(24)18(28-12)23-9-22-14-16(19)20-8-21-17(14)23/h2-4,8-9,12-13,18,24H,5-7H2,1H3,(H2,19,20,21)	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	2.80E+4	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))	BDBM50146878 (2-(6-Amino-purin-9-yl)-5-(8-methyl-2-oxo-4H-2lambd...) Show SMILES Cc1cccc2COP(=O)(OCC3CC(O)C(O3)n3cnc4c(N)ncnc34)Oc12 Show InChI InChI=1S/C18H20N5O6P/c1-10-3-2-4-11-6-26-30(25,29-15(10)11)27-7-12-5-13(24)18(28-12)23-9-22-14-16(19)20-8-21-17(14)23/h2-4,8-9,12-13,18,24H,5-7H2,1H3,(H2,19,20,21)	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