Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 2' and Ligand = 'BDBM50087216'   

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))	BDBM50087216 ((S)-6,8-Diiodo-7-(3-methoxy-benzyloxy)-2-((E)-3-p-...) Show SMILES COc1cccc(COc2c(I)cc3C[C@H](N(Cc3c2I)C(=O)\C=C\c2ccc(C)cc2)C(O)=O)c1 Show InChI InChI=1S/C28H25I2NO5/c1-17-6-8-18(9-7-17)10-11-25(32)31-15-22-20(14-24(31)28(33)34)13-23(29)27(26(22)30)36-16-19-4-3-5-21(12-19)35-2/h3-13,24H,14-16H2,1-2H3,(H,33,34)/b11-10+/t24-/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	6.20E+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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