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SMILES: CC(C)CC(CNC(=O)c1cc(ccc1C)-n1nc(cc1NC(=O)Nc1cccc2ccccc12)C(C)(C)C)C(N)=O

InChI Key: InChIKey=UJCVPBKLBYTVSS-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50327198   
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))		BDBM50327198
PNG
(5-(3-tert-butyl-5-(3-naphthalen-1-ylureido)-1H-pyr...)
Show SMILES CC(C)CC(CNC(=O)c1cc(ccc1C)-n1nc(cc1NC(=O)Nc1cccc2ccccc12)C(C)(C)C)C(N)=O
Show InChI InChI=1S/C33H40N6O3/c1-20(2)16-23(30(34)40)19-35-31(41)26-17-24(15-14-21(26)3)39-29(18-28(38-39)33(4,5)6)37-32(42)36-27-13-9-11-22-10-7-8-12-25(22)27/h7-15,17-18,20,23H,16,19H2,1-6H3,(H2,34,40)(H,35,41)(H2,36,37,42)
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Article
PubMed
 786n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to full-length GST-tagged p38alpha after 2.5 hrs by TR-FRET competition binding assay

Bioorg Med Chem Lett 20: 5787-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.097
BindingDB Entry DOI: 10.7270/Q2MC907J
More data for this
Ligand-Target Pair