Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid synthase' and Ligand = 'BDBM137185'   

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))	BDBM137185 (US8871790, 253) Show SMILES Cc1cc(C2CCC2)c(cc1C(=O)N1CCC(CC1)c1ccc(cc1)C#N)-c1ncc([nH]1)C#N Show InChI InChI=1S/C28H27N5O/c1-18-13-25(22-3-2-4-22)26(27-31-17-23(16-30)32-27)14-24(18)28(34)33-11-9-21(10-12-33)20-7-5-19(15-29)6-8-20/h5-8,13-14,17,21-22H,2-4,9-12H2,1H3,(H,31,32)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	90	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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