BDBM50377800 CHEMBL442448

SMILES: COC(=O)c1cc(ccc1O)-c1ccc(\C=C2/SC(=O)N(CCC(O)=O)C2=O)s1

InChI Key: InChIKey=QVMNWGOAVSGSIR-DHDCSXOGSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50377800   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP (Homo sapiens (Human))	BDBM50377800 (CHEMBL442448) Show SMILES COC(=O)c1cc(ccc1O)-c1ccc(\C=C2/SC(=O)N(CCC(O)=O)C2=O)s1 Show InChI InChI=1S/C19H15NO7S2/c1-27-18(25)12-8-10(2-4-13(12)21)14-5-3-11(28-14)9-15-17(24)20(19(26)29-15)7-6-16(22)23/h2-5,8-9,21H,6-7H2,1H3,(H,22,23)/b15-9-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	390	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of lymphoid specific tyrosine phosphatase				Bioorg Med Chem Lett 18: 2840-4 (2008) Article DOI: 10.1016/j.bmcl.2008.03.079 BindingDB Entry DOI: 10.7270/Q28S4QSJ
					More data for this Ligand-Target Pair