Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 2' and Ligand = 'BDBM50402661'   

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
M-phase inducer phosphatase 2 (Homo sapiens (Human))	BDBM50402661 (CHEMBL2206744) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=CC=Cc4ccco4)CC3)=NC2=O)cc1 |w:23.22,5.4,26.26,c:37,t:19| Show InChI InChI=1S/C28H30N6O4S2/c35-21-8-6-20(7-9-21)19-24-26(37)32-28(40-24)30-11-13-34-16-14-33(15-17-34)12-10-29-27-31-25(36)23(39-27)5-1-3-22-4-2-18-38-22/h1-9,18-19,35H,10-17H2,(H,29,31,36)(H,30,32,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Paris Descartes Curated by ChEMBL					Assay Description Inhibition of MBP-fused recombinant wild type CDC25B3 using fluorescein 3,6 diphosphate as substrate measured for 30 mins in presence of 1 mM dithiot...				Bioorg Med Chem Lett 22: 7345-50 (2012) Article DOI: 10.1016/j.bmcl.2012.10.072 BindingDB Entry DOI: 10.7270/Q2J67J38
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