BDBM50132237 CHEMBL320852::[Difluoro-(6-methanesulfonylaminocarbonyl-naphthalen-2-yl)-methyl]-phosphonic acid

SMILES: CS(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O

InChI Key: InChIKey=LMUPFUZBFXFBCX-UHFFFAOYSA-N

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 = 50132237   

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
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50132237 (CHEMBL320852 | [Difluoro-(6-methanesulfonylaminoca...) Show SMILES CS(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C13H12F2NO6PS/c1-24(21,22)16-12(17)10-3-2-9-7-11(5-4-8(9)6-10)13(14,15)23(18,19)20/h2-7H,1H3,(H,16,17)(H2,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
NIH Curated by ChEMBL					Assay Description Binding affinity of the compound towards recombinant human Protein-tyrosine phosphatase 1B was determined				Bioorg Med Chem Lett 13: 3005-7 (2003) BindingDB Entry DOI: 10.7270/Q22F7MV1
					More data for this Ligand-Target Pair
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50132237 (CHEMBL320852 | [Difluoro-(6-methanesulfonylaminoca...) Show SMILES CS(=O)(=O)NC(=O)c1ccc2cc(ccc2c1)C(F)(F)P(O)(O)=O Show InChI InChI=1S/C13H12F2NO6PS/c1-24(21,22)16-12(17)10-3-2-9-7-11(5-4-8(9)6-10)13(14,15)23(18,19)20/h2-7H,1H3,(H,16,17)(H2,18,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
NIH Curated by ChEMBL					Assay Description Inhibitory concentration of the compound towards recombinant human Protein-tyrosine phosphatase 1B was determined				Bioorg Med Chem Lett 13: 3005-7 (2003) BindingDB Entry DOI: 10.7270/Q22F7MV1
					More data for this Ligand-Target Pair