BDBM50324356 3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide::CHEMBL1215508
SMILES: NS(=O)(=O)c1no[n+]([O-])c1-c1ccccc1
InChI Key: InChIKey=URWBEJZZFHZFJY-UHFFFAOYSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Carbonic anhydrase 9 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | 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 | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of human CA9 by CO2 hydration activity based stopped flow assay | Bioorg Med Chem 22: 3913-21 (2014) Article DOI: 10.1016/j.bmc.2014.06.016 BindingDB Entry DOI: 10.7270/Q2Q241WD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 12 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 9.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of human CA12 by CO2 hydration activity based stopped flow assay | Bioorg Med Chem 22: 3913-21 (2014) Article DOI: 10.1016/j.bmc.2014.06.016 BindingDB Entry DOI: 10.7270/Q2Q241WD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 2 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | 38 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of human CA2 by CO2 hydration activity based stopped flow assay | Bioorg Med Chem 22: 3913-21 (2014) Article DOI: 10.1016/j.bmc.2014.06.016 BindingDB Entry DOI: 10.7270/Q2Q241WD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | 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 | 42 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of human CA1 by CO2 hydration activity based stopped flow assay | Bioorg Med Chem 22: 3913-21 (2014) Article DOI: 10.1016/j.bmc.2014.06.016 BindingDB Entry DOI: 10.7270/Q2Q241WD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
P-glycoprotein 1 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a |
Universita degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of MDR1 expressed in MDCK cells assessed as calcein AM accumulation by fluorescence assay | J Med Chem 53: 5467-75 (2010) Article DOI: 10.1021/jm100066y BindingDB Entry DOI: 10.7270/Q2JH3MC8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Multidrug resistance protein 1/Multidrug resistance associated protein 1 (Homo sapiens (Human)) | BDBM50324356 (3-phenyl-4-sulfamoyl-1,2,5-oxadiazole 2-oxide | CH...) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a |
Universita degli Studi di Torino Curated by ChEMBL | Assay Description Inhibition of MRP1 expressed in MDCK cells assessed as calcein AM accumulation by fluorescence assay | J Med Chem 53: 5467-75 (2010) Article DOI: 10.1021/jm100066y BindingDB Entry DOI: 10.7270/Q2JH3MC8 | |||||||||||
More data for this Ligand-Target Pair |