Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 2' and Ligand = 'BDBM50087212'   

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))	BDBM50087212 ((S)-7-(2-Fluoro-benzyloxy)-6,8-diiodo-2-(3-phenyl-...) Show SMILES OC(=O)[C@@H]1Cc2cc(I)c(OCc3ccccc3F)c(I)c2CN1C(=O)CCc1ccccc1 Show InChI InChI=1S/C26H22FI2NO4/c27-20-9-5-4-8-17(20)15-34-25-21(28)12-18-13-22(26(32)33)30(14-19(18)24(25)29)23(31)11-10-16-6-2-1-3-7-16/h1-9,12,22H,10-11,13-15H2,(H,32,33)/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacia & Upjohn Company Curated by ChEMBL					Assay Description Compound was measured for its inhibitory activity against Cell division cycle 25B				Bioorg Med Chem Lett 10: 649-52 (2000) BindingDB Entry DOI: 10.7270/Q2KS6QRN
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