Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 477.5 BDBM50270641

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM50270641 (CHEMBL528100 | N-(4-(1-Oxo-2,2,6,6-tetramethylpipe...) Show SMILES CC1(C)CC(CC(C)(C)N1O)NC(=O)CCCNC(=O)c1ccc(cc1)-c1n[nH]c2ccccc12 Show InChI InChI=1S/C27H35N5O3/c1-26(2)16-20(17-27(3,4)32(26)35)29-23(33)10-7-15-28-25(34)19-13-11-18(12-14-19)24-21-8-5-6-9-22(21)30-31-24/h5-6,8-9,11-14,20,35H,7,10,15-17H2,1-4H3,(H,28,34)(H,29,33)(H,30,31)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute for Medical Research Curated by ChEMBL					Assay Description Inhibition of JNK1 (unknown origin) by TR-FRET assay				J Med Chem 51: 3460-5 (2008) Article DOI: 10.1021/jm800068w BindingDB Entry DOI: 10.7270/Q2N29WR7
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