Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 2' and Ligand = 'BDBM50402660'   

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))	BDBM50402660 (CHEMBL2206745) Show SMILES Oc1ccc(C=C2SC(NCCN3CCN(CCNC4=NC(=O)C(S4)=Cc4ccc5n[nH]cc5c4)CC3)=NC2=O)cc1 |w:5.4,25.26,c:40,t:19| Show InChI InChI=1S/C29H30N8O3S2/c38-22-4-1-19(2-5-22)16-24-26(39)33-28(41-24)30-7-9-36-11-13-37(14-12-36)10-8-31-29-34-27(40)25(42-29)17-20-3-6-23-21(15-20)18-32-35-23/h1-6,15-18,38H,7-14H2,(H,32,35)(H,30,33,39)(H,31,34,40)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.90E+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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