Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Dual specificity mitogen-activated protein kinase kinase 1/2' and Ligand = 'BDBM50072152'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dual specificity mitogen-activated protein kinase kinase 1/2 (Homo sapiens (Human))	BDBM50072152 (2,3-Bis-[1-amino-1-(4-chloro-phenylsulfanyl)-meth-...) Show SMILES Clc1ccc(SC(=N)C(C#N)C(C#N)C(=N)Sc2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C18H12Cl2N4S2/c19-11-1-5-13(6-2-11)25-17(23)15(9-21)16(10-22)18(24)26-14-7-3-12(20)4-8-14/h1-8,15-16,23-24H	PDB KEGG UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.17E+4	n/a	n/a	n/a	n/a	n/a	n/a
DuPont Pharmaceuticals Company Curated by ChEMBL					Assay Description Ability to antagonise AP-1 transcriptional activity				Bioorg Med Chem Lett 8: 2839-44 (1999) BindingDB Entry DOI: 10.7270/Q2MW2HNN
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