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SMILES: CCOc1nnc([nH]1)-c1cc(C(=O)N2CCC(F)(CC2)c2ccc(cc2)C#N)c(CC)cc1C1CCC1

InChI Key: InChIKey=GQOWUYCMKKLWRH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 137150   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Fatty acid synthase


(Homo sapiens (Human))		BDBM137150
PNG
(US8871790, 218)
Show SMILES CCOc1nnc([nH]1)-c1cc(C(=O)N2CCC(F)(CC2)c2ccc(cc2)C#N)c(CC)cc1C1CCC1
Show InChI InChI=1S/C29H32FN5O2/c1-3-20-16-23(21-6-5-7-21)25(26-32-28(34-33-26)37-4-2)17-24(20)27(36)35-14-12-29(30,13-15-35)22-10-8-19(18-31)9-11-22/h8-11,16-17,21H,3-7,12-15H2,1-2H3,(H,32,33,34)
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Similars
US Patent
n/an/a 170n/an/an/an/an/an/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
More data for this
Ligand-Target Pair