BDBM50436375 CHEMBL2396725

SMILES: OC(=O)COc1cccc(c1)-c1oc2cc(O)c(cc2c1C#Cc1cccc(Cl)c1)C(O)=O

InChI Key: InChIKey=ZMRQFSIRFKMPNQ-UHFFFAOYSA-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 = 50436375   

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))	BDBM50436375 (CHEMBL2396725) Show SMILES OC(=O)COc1cccc(c1)-c1oc2cc(O)c(cc2c1C#Cc1cccc(Cl)c1)C(O)=O Show InChI InChI=1S/C25H15ClO7/c26-16-5-1-3-14(9-16)7-8-18-19-11-20(25(30)31)21(27)12-22(19)33-24(18)15-4-2-6-17(10-15)32-13-23(28)29/h1-6,9-12,27H,13H2,(H,28,29)(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Indiana University School of Medicine Curated by ChEMBL					Assay Description Inhibition of N-terminal 6xHis-tagged LYP catalytic domain (1 to 294) (unknown origin) expressed in Escherichia coli BL21(DE3) using pNPP as substrat...				J Med Chem 56: 4990-5008 (2013) Article DOI: 10.1021/jm400248c BindingDB Entry DOI: 10.7270/Q2N017XW
					More data for this Ligand-Target Pair