BDBM50330605 1-(3-amino-6-(3,5-dimethoxyphenyl)pyrazin-2-yl)piperidine-4-carboxylic acid::CHEMBL1277201

SMILES: COc1cc(OC)cc(c1)-c1cnc(N)c(n1)N1CCC(CC1)C(O)=O

InChI Key: InChIKey=SNJGUTSRBTYLSN-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50330605   

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 Nek2 (Homo sapiens (Human))	BDBM50330605 (1-(3-amino-6-(3,5-dimethoxyphenyl)pyrazin-2-yl)pip...) Show SMILES COc1cc(OC)cc(c1)-c1cnc(N)c(n1)N1CCC(CC1)C(O)=O Show InChI InChI=1S/C18H22N4O4/c1-25-13-7-12(8-14(9-13)26-2)15-10-20-16(19)17(21-15)22-5-3-11(4-6-22)18(23)24/h7-11H,3-6H2,1-2H3,(H2,19,20)(H,23,24)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Institute of Cancer Research Curated by ChEMBL					Assay Description Inhibition of NEK2 by microfluidic assay				J Med Chem 53: 7682-98 (2010) Article DOI: 10.1021/jm1008727 BindingDB Entry DOI: 10.7270/Q23J3D79
					More data for this Ligand-Target Pair