BDBM50259568 3-{[(1R)-1-Phenylethyl]amino}-4-(pyrimidin-4-ylamino)cyclobut-3-ene-1,2-dione::CHEMBL512454

SMILES: C[C@@H](Nc1c(Nc2ccncn2)c(=O)c1=O)c1ccccc1

InChI Key: InChIKey=OLCPSDXSIOYXHG-SNVBAGLBSA-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 = 50259568   

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
MAP kinase-activated protein kinase 2 (Homo sapiens (Human))	BDBM50259568 (3-{[(1R)-1-Phenylethyl]amino}-4-(pyrimidin-4-ylami...) Show SMILES C[C@@H](Nc1c(Nc2ccncn2)c(=O)c1=O)c1ccccc1 |r| Show InChI InChI=1S/C16H14N4O2/c1-10(11-5-3-2-4-6-11)19-13-14(16(22)15(13)21)20-12-7-8-17-9-18-12/h2-10,19H,1H3,(H,17,18,20)/t10-/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of human recombinant MK2				Bioorg Med Chem 17: 3342-51 (2009) Article DOI: 10.1016/j.bmc.2009.03.041 BindingDB Entry DOI: 10.7270/Q2WW7HK4
					More data for this Ligand-Target Pair