BDBM50094834 CHEMBL148167::{3-(1H-Imidazol-4-yl)-2-[3-(4-sulfamoyl-phenyl)-thioureido]-propionylamino}-acetic acid
SMILES: NS(=O)(=O)c1ccc(NC(=S)NC(Cc2cnc[nH]2)C(=O)NCC(O)=O)cc1
InChI Key: InChIKey=NMAZHZSPSGSCEM-UHFFFAOYSA-N
Data: 3 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)) | BDBM50094834 (CHEMBL148167 | {3-(1H-Imidazol-4-yl)-2-[3-(4-sulfa...) | PDB MMDB Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze Curated by ChEMBL | Assay Description Inhibitory activity against human recombinant carbonic anhydrase II | J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic Anhydrase IV (Bos taurus (bovine)) | BDBM50094834 (CHEMBL148167 | {3-(1H-Imidazol-4-yl)-2-[3-(4-sulfa...) | Reactome pathway KEGG GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze Curated by ChEMBL | Assay Description Inhibitory activity against bovine carbonic anhydrase IV from lung microsomes | J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Carbonic anhydrase 1 (Homo sapiens (Human)) | BDBM50094834 (CHEMBL148167 | {3-(1H-Imidazol-4-yl)-2-[3-(4-sulfa...) | PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 13 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ degli Studi di Firenze Curated by ChEMBL | Assay Description Inhibitory activity against human recombinant carbonic anhydrase I | J Med Chem 43: 4884-92 (2000) BindingDB Entry DOI: 10.7270/Q22B8ZQQ | |||||||||||
More data for this Ligand-Target Pair |