BDBM50314444 2-(4-chlorophenyl)-10-thia-5,7,12-triazatetracyclo[11.7.0.0^{3,11}.0^{4,9}]icosa-1(13),2,4(9),5,7,11-hexaen-8-amine::CHEMBL1094018

SMILES: Nc1ncnc2c1sc1nc3CCCCCCCc3c(-c3ccc(Cl)cc3)c21

InChI Key: InChIKey=JGWFGPLJAWDQNW-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 = 50314444   

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
Eukaryotic elongation factor 2 kinase (Homo sapiens (Human))	BDBM50314444 (2-(4-chlorophenyl)-10-thia-5,7,12-triazatetracyclo...) Show SMILES Nc1ncnc2c1sc1nc3CCCCCCCc3c(-c3ccc(Cl)cc3)c21 Show InChI InChI=1S/C22H21ClN4S/c23-14-10-8-13(9-11-14)17-15-6-4-2-1-3-5-7-16(15)27-22-18(17)19-20(28-22)21(24)26-12-25-19/h8-12H,1-7H2,(H2,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Myriad Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of GST tagged eEf2K expressed in Escherichia coli by fluorometric method				Bioorg Med Chem Lett 20: 2283-6 (2010) Article DOI: 10.1016/j.bmcl.2010.02.005 BindingDB Entry DOI: 10.7270/Q2F18ZVT
					More data for this Ligand-Target Pair