BDBM14640 3-(5-cyanopyrazin-2-yl)-1-[2-methoxy-4-(piperidin-1-ylmethyl)phenyl]urea::N-pyrazinylurea Analog 29a

SMILES: COc1cc(CN2CCCCC2)ccc1NC(=O)Nc1cnc(cn1)C#N

InChI Key: InChIKey=LGVKFJFYXUDITJ-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 14640   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM14640 (3-(5-cyanopyrazin-2-yl)-1-[2-methoxy-4-(piperidin-...) Show SMILES COc1cc(CN2CCCCC2)ccc1NC(=O)Nc1cnc(cn1)C#N Show InChI InChI=1S/C19H22N6O2/c1-27-17-9-14(13-25-7-3-2-4-8-25)5-6-16(17)23-19(26)24-18-12-21-15(10-20)11-22-18/h5-6,9,11-12H,2-4,7-8,13H2,1H3,(H2,22,23,24,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories					Assay Description Chk1 kinase activity was assayed in reaction buffer containing substrate, enzyme, and inhibitor in the presence of 5uM ATP/[gamma-33P] ATP. 33P incor...				Bioorg Med Chem Lett 16: 2293-8 (2006) Article DOI: 10.1016/j.bmcl.2006.01.028 BindingDB Entry DOI: 10.7270/Q26971TD
					More data for this Ligand-Target Pair