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Compile Data Set for Download or QSAR

Found 1 hit of ic50 for monomerid = 392939   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Receptor-interacting serine/threonine-protein kinase 3


(Homo sapiens (Human))
BDBM392939
PNG
(US10301306, Example 137)
Show SMILES Oc1ccccc1-c1c2c(CCNC2=O)n(Cc2ccc(F)cc2C#N)c1-c1ccncc1 |(-2.63,1.99,;-1.54,3.08,;-1.94,4.57,;-.85,5.66,;.63,5.26,;1.03,3.77,;-.06,2.68,;.34,1.19,;1.81,.72,;1.81,-.82,;3.14,-1.59,;4.47,-.82,;4.47,.72,;3.14,1.49,;3.14,3.03,;.34,-1.3,;-.06,-2.79,;1.03,-3.88,;2.52,-3.48,;3.61,-4.57,;3.21,-6.05,;4.3,-7.14,;1.72,-6.45,;.58,-5.38,;-.91,-5.78,;-2.41,-6.1,;-.56,-.05,;-2.1,-.05,;-2.87,1.28,;-4.41,1.28,;-5.18,-.05,;-4.41,-1.39,;-2.87,-1.39,)|
Show InChI InChI=1S/C26H19FN4O2/c27-19-6-5-17(18(13-19)14-28)15-31-21-9-12-30-26(33)24(21)23(20-3-1-2-4-22(20)32)25(31)16-7-10-29-11-8-16/h1-8,10-11,13,32H,9,12,15H2,(H,30,33)
PDB

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PC cid
PC sid
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US Patent
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