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SMILES: C[C@@H]1CNc2c(sc3ccc4nc(Nc5cc(F)nc(OCC6(C)COC6)n5)ccc4c23)C(=O)N1

InChI Key: InChIKey=XCTOSLYYNGDVAI-GFCCVEGCSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 348788   
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
MAP kinase-activated protein kinase 2


(Homo sapiens (Human))		BDBM348788
PNG
(US9790235, Number I-39)
Show SMILES C[C@@H]1CNc2c(sc3ccc4nc(Nc5cc(F)nc(OCC6(C)COC6)n5)ccc4c23)C(=O)N1 |r|
Show InChI InChI=1S/C24H23FN6O3S/c1-12-8-26-20-19-13-3-6-17(28-14(13)4-5-15(19)35-21(20)22(32)27-12)30-18-7-16(25)29-23(31-18)34-11-24(2)9-33-10-24/h3-7,12,26H,8-11H2,1-2H3,(H,27,32)(H,28,29,30,31)/t12-/m1/s1
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US Patent
n/an/a<100n/an/an/an/an/an/a



Celgene CAR LLC

US Patent


Assay Description
Compounds I-1 through I-50 of the invention were assayed in a mass spectrometric assay to measure their ability to covalently modify MK2 protein. The...

US Patent US9790235 (2017)


BindingDB Entry DOI: 10.7270/Q2NZ89RS
More data for this
Ligand-Target Pair