Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Fatty acid synthase' and Ligand = 'BDBM136992'   

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))	BDBM136992 (US8871790, 57) Show SMILES FC1(CCN(CC1)C(=O)c1ccc(Cl)c(NC(=O)c2ccc(nc2)N2CCC2)c1)c1ccc(cc1)C#N Show InChI InChI=1S/C28H25ClFN5O2/c29-23-8-4-20(16-24(23)33-26(36)21-5-9-25(32-18-21)34-12-1-13-34)27(37)35-14-10-28(30,11-15-35)22-6-2-19(17-31)3-7-22/h2-9,16,18H,1,10-15H2,(H,33,36)	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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