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SMILES: C[C@H](Nc1cc(ccn1)N(Cc1ccc(F)cc1)C(=O)c1ccccc1)c1ccccc1

InChI Key: InChIKey=JLHIFVIPMABRDG-FQEVSTJZSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50315873   
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
Mitogen-activated protein kinase 14


(Homo sapiens (Human))		BDBM50315873
PNG
((S)-N-(4-fluorobenzyl)-N-(2-(1-phenylethylamino)py...)
Show SMILES C[C@H](Nc1cc(ccn1)N(Cc1ccc(F)cc1)C(=O)c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C27H24FN3O/c1-20(22-8-4-2-5-9-22)30-26-18-25(16-17-29-26)31(19-21-12-14-24(28)15-13-21)27(32)23-10-6-3-7-11-23/h2-18,20H,19H2,1H3,(H,29,30)/t20-/m0/s1
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n/an/a 589n/an/an/an/an/an/a



Scios Inc.

Curated by ChEMBL


Assay Description
Inhibition of p38alpha assessed as inhibition of gamma-32p-ATP incorporation into biotin peptide substrate after 60 mins by scintillation counter

Bioorg Med Chem Lett 20: 2556-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.02.088
BindingDB Entry DOI: 10.7270/Q2VT1S84
More data for this
Ligand-Target Pair