Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Tyrosine-protein phosphatase non-receptor type 1' and Ligand = 'BDBM50254055'   

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 1 (Homo sapiens (Human))	BDBM50254055 (CHEMBL4080452) Show SMILES COC(=O)c1scc(c1OC)-c1ccc(NC(=O)c2ccc3ccccc3c2)cc1 Show InChI InChI=1S/C24H19NO4S/c1-28-21-20(14-30-22(21)24(27)29-2)16-9-11-19(12-10-16)25-23(26)18-8-7-15-5-3-4-6-17(15)13-18/h3-14H,1-2H3,(H,25,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.25E+3	n/a	n/a	n/a	n/a	n/a	n/a
K L University Curated by ChEMBL					Assay Description Inhibition of recombinant PTP1B (unknown origin) using pNPP substrate				Bioorg Med Chem Lett 27: 3558-3564 (2017) Article DOI: 10.1016/j.bmcl.2017.05.047 BindingDB Entry DOI: 10.7270/Q2JS9SVN
					More data for this Ligand-Target Pair