BDBM50259378 3-(Benzylamino)-4-(pyridin-4-ylamino)cyclobut-3-ene-1,2-dione::CHEMBL466700

SMILES: O=c1c(NCc2ccccc2)c(Nc2ccncc2)c1=O

InChI Key: InChIKey=YFNYENFUDVWQQF-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 = 50259378   

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))	BDBM50259378 (3-(Benzylamino)-4-(pyridin-4-ylamino)cyclobut-3-en...) Show SMILES O=c1c(NCc2ccccc2)c(Nc2ccncc2)c1=O Show InChI InChI=1S/C16H13N3O2/c20-15-13(18-10-11-4-2-1-3-5-11)14(16(15)21)19-12-6-8-17-9-7-12/h1-9,18H,10H2,(H,17,19)	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	8.80E+4	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				3D Structure (docked)