BDBM50045385 CHEMBL3315289

SMILES: FC1(CCNCC1)c1ccc(cc1)-n1ccnc1-c1ccc(o1)-c1ccc(Cl)cc1

InChI Key: InChIKey=BPDRSYOIAMRYHS-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 = 50045385   

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))	BDBM50045385 (CHEMBL3315289) Show SMILES FC1(CCNCC1)c1ccc(cc1)-n1ccnc1-c1ccc(o1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C24H21ClFN3O/c25-19-5-1-17(2-6-19)21-9-10-22(30-21)23-28-15-16-29(23)20-7-3-18(4-8-20)24(26)11-13-27-14-12-24/h1-10,15-16,27H,11-14H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of MK2 (unknown origin) incubated for 30 mins by MK2 IMAP assay				Bioorg Med Chem Lett 24: 3609-13 (2014) Article DOI: 10.1016/j.bmcl.2014.05.024 BindingDB Entry DOI: 10.7270/Q2F47QR7
					More data for this Ligand-Target Pair