BDBM50312665 CHEMBL1088572::Sodium 2-(2-Fluorophenyl)-6,7-methylenedioxyquinolin-4-yl hydrogen phosphate
SMILES: OP([O-])(=O)OC1CC(=Nc2cc3OCOc3cc12)c1ccccc1F
InChI Key: InChIKey=PPSJOHMGLWYWEX-UHFFFAOYSA-M
Data: 7 IC50
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 type IVA 1 (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 676 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human PTP4A1 by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protein tyrosine phosphatase type IVA 2 (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 314 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human PTP4A2 by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Protein-tyrosine phosphatase 4A3 (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 4.93E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human PTP4A3 by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin D (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 9.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human cathepsin D by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cytochrome P450 2D6 (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 3.22E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human CYP2D6 by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin E (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.71E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human cathepsin E by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cathepsin S (Homo sapiens (Human)) | BDBM50312665 (CHEMBL1088572 | Sodium 2-(2-Fluorophenyl)-6,7-meth...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 1.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
China Medical University Curated by ChEMBL | Assay Description Inhibition of human cathepsin S by enzyme assay | J Med Chem 53: 1616-26 (2010) Article DOI: 10.1021/jm901292j BindingDB Entry DOI: 10.7270/Q2XG9R8X | |||||||||||
More data for this Ligand-Target Pair |