Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phosphotransferase' and Ligand = 'BDBM50422787'   

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
Phosphotransferase (Trypanosoma cruzi)	BDBM50422787 ((BUTYL(ETHYL)AMINO)METHYLENEDIPHOSPHONIC ACID) Show SMILES CCCCN(CC)C(P(O)(O)=O)P(O)(O)=O Show InChI InChI=1S/C7H19NO6P2/c1-3-5-6-8(4-2)7(15(9,10)11)16(12,13)14/h7H,3-6H2,1-2H3,(H2,9,10,11)(H2,12,13,14)	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.31E+12	n/a	n/a	n/a	n/a	n/a	n/a
University of Illinois at Urbana-Champaign Curated by ChEMBL					Assay Description Inhibitory activity against Trypanosoma cruzi hexokinase				J Med Chem 49: 215-23 (2006) Article DOI: 10.1021/jm0582625 BindingDB Entry DOI: 10.7270/Q2BV7G6G
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