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SMILES: CCC(=O)Nc1cc(ccn1)-c1c(-c2ccc(F)cc2)c2c(cc[nH]c2=O)n1Cc1ccc(cc1F)C(F)(F)F

InChI Key: InChIKey=NGQYKHWSKXUEOI-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 392958   
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
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))		BDBM392958
PNG
(N-(4-(1-(2-Fluoro-4-(trifluoromethyl)benzyl)-3-(4-...)
Show SMILES CCC(=O)Nc1cc(ccn1)-c1c(-c2ccc(F)cc2)c2c(cc[nH]c2=O)n1Cc1ccc(cc1F)C(F)(F)F
Show InChI InChI=1S/C29H21F5N4O2/c1-2-24(39)37-23-13-17(9-11-35-23)27-25(16-4-7-20(30)8-5-16)26-22(10-12-36-28(26)40)38(27)15-18-3-6-19(14-21(18)31)29(32,33)34/h3-14H,2,15H2,1H3,(H,36,40)(H,35,37,39)
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n/an/a<30n/an/an/an/an/an/a



GSK



Assay Description
The assays were performed in black 1536-well plates. The final assay volume of 2 μl contained a mixture of a fluorescently labeled HTRF probe, T...

Bioorg Med Chem Lett 18: 5018-22 (2008)


BindingDB Entry DOI: 10.7270/Q2M90C19
More data for this
Ligand-Target Pair