Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 800.5 BDBM50306212

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

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
Receptor-type tyrosine-protein phosphatase beta (Homo sapiens (Human))	BDBM50306212 (CHEMBL592901 | {[25,26,27,28-tetrahydroxy-11,17,23...) Show SMILES Oc1c2Cc3cc(CP(O)(O)=O)cc(Cc4cc(CP(O)(O)=O)cc(Cc5cc(CP(O)(O)=O)cc(Cc1cc(CP(O)(O)=O)c2)c5O)c4O)c3O Show InChI InChI=1S/C32H36O16P4/c33-29-21-1-17(13-49(37,38)39)2-22(29)10-24-5-19(15-51(43,44)45)6-27(31(24)35)12-28-8-20(16-52(46,47)48)7-26(32(28)36)11-25-4-18(14-50(40,41)42)3-23(9-21)30(25)34/h1-8,33-36H,9-16H2,(H2,37,38,39)(H2,40,41,42)(H2,43,44,45)(H2,46,47,48)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
National Academy of Sciences of Ukraine Curated by ChEMBL					Assay Description Inhibition of human recombinant PTPbeta				Bioorg Med Chem Lett 20: 483-7 (2010) Article DOI: 10.1016/j.bmcl.2009.11.126 BindingDB Entry DOI: 10.7270/Q2RB74QM
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