BDBM50069997 Ammonium; [7-(difluoro-phosphono-methyl)-naphthalen-2-yl]-difluoro-methanephosphonate::CHEMBL119459

SMILES: OP(O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P(O)([O-])=O

InChI Key: InChIKey=VHKBLEYUHBIBNR-UHFFFAOYSA-M

Data: 1 KI  2 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 3 hits for monomerid = 50069997   

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))	BDBM50069997 (Ammonium; [7-(difluoro-phosphono-methyl)-naphthale...) Show SMILES OP(O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P(O)([O-])=O Show InChI InChI=1S/C12H10F4O6P2/c13-11(14,23(17,18)19)9-3-1-7-2-4-10(6-8(7)5-9)12(15,16)24(20,21)22/h1-6H,(H2,17,18,19)(H2,20,21,22)/p-1	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	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Toronto Curated by ChEMBL					Assay Description Compound was evaluated for inhibitory constant against PTP1B				Bioorg Med Chem Lett 8: 345-50 (1999) BindingDB Entry DOI: 10.7270/Q2TD9XV0
					More data for this Ligand-Target Pair				3D Structure (docked)
Protein-tyrosine phosphatase 1B (Homo sapiens (Human))	BDBM50069997 (Ammonium; [7-(difluoro-phosphono-methyl)-naphthale...) Show SMILES OP(O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P(O)([O-])=O Show InChI InChI=1S/C12H10F4O6P2/c13-11(14,23(17,18)19)9-3-1-7-2-4-10(6-8(7)5-9)12(15,16)24(20,21)22/h1-6H,(H2,17,18,19)(H2,20,21,22)/p-1	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	2.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Toronto Curated by ChEMBL					Assay Description Compound was evaluated for 50% inhibition of PTP1B using uM)				Bioorg Med Chem Lett 8: 345-50 (1999) BindingDB Entry DOI: 10.7270/Q2TD9XV0
					More data for this Ligand-Target Pair				3D Structure (docked)
Leukocyte common antigen (Homo sapiens (Human))	BDBM50069997 (Ammonium; [7-(difluoro-phosphono-methyl)-naphthale...) Show SMILES OP(O)(=O)C(F)(F)c1ccc2ccc(cc2c1)C(F)(F)P(O)([O-])=O Show InChI InChI=1S/C12H10F4O6P2/c13-11(14,23(17,18)19)9-3-1-7-2-4-10(6-8(7)5-9)12(15,16)24(20,21)22/h1-6H,(H2,17,18,19)(H2,20,21,22)/p-1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80E+5	n/a	n/a	n/a	n/a	n/a	n/a
University of Toronto Curated by ChEMBL					Assay Description Compound was evaluated for 50% inhibition of CD45 using uM)				Bioorg Med Chem Lett 8: 345-50 (1999) BindingDB Entry DOI: 10.7270/Q2TD9XV0
					More data for this Ligand-Target Pair