BDBM50045410 CHEMBL3314155

SMILES: Clc1ccc(cc1)-c1ccc(o1)-c1nccn1-c1ccc(cc1)C1CCNCC1

InChI Key: InChIKey=XFSLOTUELHMEQA-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 = 50045410   

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))	BDBM50045410 (CHEMBL3314155) Show SMILES Clc1ccc(cc1)-c1ccc(o1)-c1nccn1-c1ccc(cc1)C1CCNCC1 Show InChI InChI=1S/C24H22ClN3O/c25-20-5-1-19(2-6-20)22-9-10-23(29-22)24-27-15-16-28(24)21-7-3-17(4-8-21)18-11-13-26-14-12-18/h1-10,15-16,18,26H,11-14H2	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	37	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