Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Carbonic anhydrase 4 | ||
| Ligand | BDBM50211594 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1636649 (CHEMBL3879547) | ||
| Ki | 198±n/a nM | ||
| Citation |  Altug, C; Günes, H; Nocentini, A; Monti, SM; Buonanno, M; Supuran, CT Synthesis of isoxazole-containing sulfonamides with potent carbonic anhydrase II and VII inhibitory properties. Bioorg Med Chem25:1456-1464 (2017) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Carbonic anhydrase 4 | |||
| Name: | Carbonic anhydrase 4 | ||
| Synonyms: | CA-IV | CA4 | CAH4_HUMAN | Carbonate dehydratase IV | Carbonic anhydrase | Carbonic anhydrase 4 (CA IV) | Carbonic anhydrase IV (CA IV) | ||
| Type: | Enzyme | ||
| Mol. Mass.: | 35037.98 | ||
| Organism: | Homo sapiens (Human) | ||
| Description: | P22748 | ||
| Residue: | 312 | ||
| Sequence: |
| ||
| BDBM50211594 | |||
| n/a | |||
| Name | BDBM50211594 | ||
| Synonyms: | CHEMBL3927339 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C23H15Cl3N4O5S | ||
| Mol. Mass. | 565.813 | ||
| SMILES | NS(=O)(=O)c1ccc(NC(=O)c2c(NC(=O)c3ccc(Cl)cc3)onc2-c2c(Cl)cccc2Cl)cc1 |(15.83,-4.94,;14.49,-5.71,;12.94,-5.71,;13.71,-4.37,;14.49,-7.25,;15.82,-8.01,;15.83,-9.55,;14.5,-10.32,;14.5,-11.86,;15.83,-12.62,;17.16,-11.85,;15.84,-14.15,;14.6,-15.06,;13.14,-14.59,;11.99,-15.63,;12.32,-17.15,;10.52,-15.17,;10.19,-13.65,;8.72,-13.19,;7.57,-14.23,;6.1,-13.76,;7.91,-15.75,;9.39,-16.21,;15.08,-16.51,;16.62,-16.51,;17.08,-15.04,;18.62,-15.04,;19.38,-13.71,;18.6,-12.37,;20.92,-13.7,;21.7,-15.04,;20.94,-16.38,;19.39,-16.38,;18.62,-17.72,;13.17,-9.55,;13.17,-8.02,)| | ||
| Structure | 
| ||