BDBM50243237 [2-Bromo-4-(40-bromo-30-sulfamoylbiphenyl-4-ylmethylsulfanylmethyl)phenyl]-methanesulfonate, ammonium salt

SMILES: NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(CS([O-])(=O)=O)c(Br)c2)cc1

InChI Key: InChIKey=UHICBCDEJAVVFZ-UHFFFAOYSA-M

Data: 1 KI  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 2 hits for monomerid = 50243237   

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
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50243237 ([2-Bromo-4-(40-bromo-30-sulfamoylbiphenyl-4-ylmeth...) Show SMILES NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(CS([O-])(=O)=O)c(Br)c2)cc1 Show InChI InChI=1S/C21H19Br2NO5S3/c22-19-8-7-17(10-21(19)32(24,28)29)16-4-1-14(2-5-16)11-30-12-15-3-6-18(20(23)9-15)13-31(25,26)27/h1-10H,11-13H2,(H2,24,28,29)(H,25,26,27)/p-1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	1.03E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Waterloo Curated by ChEMBL					Assay Description Inhibition of human PTP1B expressed in Escherichia coli BL21(DE3) cells				Bioorg Med Chem 16: 6764-77 (2008) Article DOI: 10.1016/j.bmc.2008.05.062 BindingDB Entry DOI: 10.7270/Q2930V2P
					More data for this Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 1 (Homo sapiens (Human))	BDBM50243237 ([2-Bromo-4-(40-bromo-30-sulfamoylbiphenyl-4-ylmeth...) Show SMILES NS(=O)(=O)c1cc(ccc1Br)-c1ccc(CSCc2ccc(CS([O-])(=O)=O)c(Br)c2)cc1 Show InChI InChI=1S/C21H19Br2NO5S3/c22-19-8-7-17(10-21(19)32(24,28)29)16-4-1-14(2-5-16)11-30-12-15-3-6-18(20(23)9-15)13-31(25,26)27/h1-10H,11-13H2,(H2,24,28,29)(H,25,26,27)/p-1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Waterloo Curated by ChEMBL					Assay Description Inhibition of human PTP1B expressed in Escherichia coli BL21(DE3) cells				Bioorg Med Chem 16: 6764-77 (2008) Article DOI: 10.1016/j.bmc.2008.05.062 BindingDB Entry DOI: 10.7270/Q2930V2P
					More data for this Ligand-Target Pair