Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 22' and Ligand = 'BDBM50393490'   

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
Tyrosine-protein phosphatase non-receptor type 22 (Homo sapiens (Human))	BDBM50393490 (CHEMBL2159964) Show SMILES Cc1cccc2cc(C(N3CCN(CC3)C(c3ccccc3)c3ccccc3)c3nnnn3C3CCCC3)c(=O)[nH]c12 Show InChI InChI=1S/C34H37N7O/c1-24-11-10-16-27-23-29(34(42)35-30(24)27)32(33-36-37-38-41(33)28-17-8-9-18-28)40-21-19-39(20-22-40)31(25-12-4-2-5-13-25)26-14-6-3-7-15-26/h2-7,10-16,23,28,31-32H,8-9,17-22H2,1H3,(H,35,42)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.33E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Southern California Curated by ChEMBL					Assay Description Inhibition of LYP expressed in Escherichia coli BL21 using pNPP substrate				J Med Chem 54: 1640-54 (2011) Article DOI: 10.1021/jm101202j BindingDB Entry DOI: 10.7270/Q2RN38Z0
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