Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fructose-1,6-bisphosphatase 1' and Ligand = 'BDBM50335035'   

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
Fructose-1,6-bisphosphatase 1 (Homo sapiens (Human))	BDBM50335035 (2-Amino-5-neopentyl-4-[2-(5-phosphono)furanyl]thia...) Show SMILES Nc1nc(-c2ccc(o2)P(O)(O)=O)c(CC(F)(F)F)s1 Show InChI InChI=1S/C9H8F3N2O4PS/c10-9(11,12)3-5-7(14-8(13)20-5)4-1-2-6(18-4)19(15,16)17/h1-2H,3H2,(H2,13,14)(H2,15,16,17)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
Metabasis Therapeutics, Inc. Curated by ChEMBL					Assay Description Inhibition of human liver FBP				J Med Chem 54: 153-65 (2011) Article DOI: 10.1021/jm101035x BindingDB Entry DOI: 10.7270/Q2CN74WJ
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