Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Fatty acid synthase' and Ligand = 'BDBM244769'   

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
Fatty acid synthase (Homo sapiens (Human))	BDBM244769 (US10226449, cpd 381 | US9428502, 381) Show SMILES CO[C@H]1CC[C@@H](CC1)c1nc(c([nH]1)-c1cc(ccc1C)C(=O)N1CC(C1)c1ccc(cc1)C#N)C(F)(F)F |r,wU:5.8,wD:2.1,(-12.26,3.14,;-11.49,1.8,;-9.95,1.8,;-9.18,.47,;-7.64,.47,;-6.87,1.8,;-7.64,3.14,;-9.18,3.14,;-5.33,1.8,;-4.43,3.05,;-2.93,2.6,;-2.96,1.03,;-4.43,.56,;-1.63,.26,;-.29,1.03,;1.04,.26,;1.04,-1.28,;-.29,-2.05,;-1.63,-1.28,;-2.96,-2.05,;2.37,1.03,;2.37,2.57,;3.71,.26,;4.11,-1.22,;5.59,-.83,;5.19,.66,;6.93,-1.6,;6.93,-3.14,;8.26,-3.91,;9.64,-3.16,;9.59,-1.6,;8.26,-.83,;10.98,-3.93,;12.31,-4.7,;-1.68,3.5,;-.44,4.41,;-2.59,4.75,;-.78,2.26,)| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Conforma Therapeutics Corporation					Assay Description FASN activity of the SKBr3 cell extract was determined by measuring either NADPH oxidation or the amount of thiol-containing coenzyme A (CoA) release...				J Med Chem 49: 5352-62 (2006) BindingDB Entry DOI: 10.7270/Q27M0B78
					More data for this Ligand-Target Pair
Fatty acid synthase (Homo sapiens (Human))	BDBM244769 (US10226449, cpd 381 | US9428502, 381) Show SMILES CO[C@H]1CC[C@@H](CC1)c1nc(c([nH]1)-c1cc(ccc1C)C(=O)N1CC(C1)c1ccc(cc1)C#N)C(F)(F)F |r,wU:5.8,wD:2.1,(-12.26,3.14,;-11.49,1.8,;-9.95,1.8,;-9.18,.47,;-7.64,.47,;-6.87,1.8,;-7.64,3.14,;-9.18,3.14,;-5.33,1.8,;-4.43,3.05,;-2.93,2.6,;-2.96,1.03,;-4.43,.56,;-1.63,.26,;-.29,1.03,;1.04,.26,;1.04,-1.28,;-.29,-2.05,;-1.63,-1.28,;-2.96,-2.05,;2.37,1.03,;2.37,2.57,;3.71,.26,;4.11,-1.22,;5.59,-.83,;5.19,.66,;6.93,-1.6,;6.93,-3.14,;8.26,-3.91,;9.64,-3.16,;9.59,-1.6,;8.26,-.83,;10.98,-3.93,;12.31,-4.7,;-1.68,3.5,;-.44,4.41,;-2.59,4.75,;-.78,2.26,)| Show InChI	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	4
3-V Biosciences, Inc. US Patent					Assay Description The FASN enzyme was isolated from SKBr3 cells. SKBr3 is a human breast cancer cell-line with high levels of FASN expression. It is estimated that FAS...				US Patent US9428502 (2016) BindingDB Entry DOI: 10.7270/Q20G3J23
					More data for this Ligand-Target Pair