BDBM50146886 2-Amino-9-[4-(8-methyl-2-oxo-4H-2lambda*5*-benzo[1,3,2]dioxaphosphinin-2-yloxymethyl)-cyclopent-2-enyl]-1,9-dihydro-purin-6-one::CHEMBL330237

SMILES: Cc1cccc2COP(=O)(OCC3CC(C=C3)n3cnc4c3nc(N)[nH]c4=O)Oc12

InChI Key: InChIKey=LHGAUFVMLCRJDH-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 = 50146886   

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
Cholinesterase (Homo sapiens (Human))	BDBM50146886 (2-Amino-9-[4-(8-methyl-2-oxo-4H-2lambda*5*-benzo[1...) Show SMILES Cc1cccc2COP(=O)(OCC3CC(C=C3)n3cnc4c3nc(N)[nH]c4=O)Oc12 |c:15| Show InChI InChI=1S/C19H20N5O5P/c1-11-3-2-4-13-9-28-30(26,29-16(11)13)27-8-12-5-6-14(7-12)24-10-21-15-17(24)22-19(20)23-18(15)25/h2-6,10,12,14H,7-9H2,1H3,(H3,20,22,23,25)	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	2.50E+3	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))	BDBM50146886 (2-Amino-9-[4-(8-methyl-2-oxo-4H-2lambda*5*-benzo[1...) Show SMILES Cc1cccc2COP(=O)(OCC3CC(C=C3)n3cnc4c3nc(N)[nH]c4=O)Oc12 |c:15| Show InChI InChI=1S/C19H20N5O5P/c1-11-3-2-4-13-9-28-30(26,29-16(11)13)27-8-12-5-6-14(7-12)24-10-21-15-17(24)22-19(20)23-18(15)25/h2-6,10,12,14H,7-9H2,1H3,(H3,20,22,23,25)	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