BDBM50294018 CHEMBL549331::N-(2-Fluorobenzyl)(4-sulphonamide phenyl)ethanamine
SMILES: NS(=O)(=O)c1ccc(CCNCc2ccccc2F)cc1
InChI Key: InChIKey=RSBCSHUOPBBKNZ-UHFFFAOYSA-N
Data: 2 KI
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 2 (Homo sapiens (Human)) | BDBM50294018 (CHEMBL549331 | N-(2-Fluorobenzyl)(4-sulphonamide p...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 6.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
ENSCM/UMII/UMR-CNRS 5635 Curated by ChEMBL | Assay Description Inhibition of human erythrocytes carbonic anhydrase 2 by CO2 hydration assay | J Med Chem 52: 4853-9 (2009) Article DOI: 10.1021/jm900449v BindingDB Entry DOI: 10.7270/Q26M36VH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM50294018 (CHEMBL549331 | N-(2-Fluorobenzyl)(4-sulphonamide p...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 260 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
ENSCM/UMII/UMR-CNRS 5635 Curated by ChEMBL | Assay Description Inhibition of human erythrocytes carbonic anhydrase 1 by CO2 hydration assay | J Med Chem 52: 4853-9 (2009) Article DOI: 10.1021/jm900449v BindingDB Entry DOI: 10.7270/Q26M36VH | |||||||||||
More data for this Ligand-Target Pair |