Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid synthase' and Ligand = 'BDBM137242'   

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))	BDBM137242 (US8871790, 321) Show SMILES FC1(CCN(CC1)C(=O)c1ccc(Cl)c(NC(=O)NC2CCOC2)c1)c1ccc(cc1)C#N Show InChI InChI=1S/C24H24ClFN4O3/c25-20-6-3-17(13-21(20)29-23(32)28-19-7-12-33-15-19)22(31)30-10-8-24(26,9-11-30)18-4-1-16(14-27)2-5-18/h1-6,13,19H,7-12,15H2,(H2,28,29,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
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 US8871790 (2014) BindingDB Entry DOI: 10.7270/Q2PG1QD3
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