Search and Browse
Download
Enter Data
| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Carbonic anhydrase 4 | ||
| Ligand | BDBM50211602 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_1636649 (CHEMBL3879547) | ||
| Ki | 71±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: |
| ||
| BDBM50211602 | |||
| n/a | |||
| Name | BDBM50211602 | ||
| Synonyms: | CHEMBL3918052 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C24H18Cl2N4O6S | ||
| Mol. Mass. | 561.394 | ||
| SMILES | COc1ccc(cc1)C(=O)Nc1onc(c1C(=O)Nc1ccc(cc1)S(N)(=O)=O)-c1c(Cl)cccc1Cl |(4.95,-14.93,;6.1,-13.89,;7.57,-14.35,;8.72,-13.3,;10.19,-13.77,;10.52,-15.28,;9.39,-16.33,;7.91,-15.87,;11.99,-15.75,;12.32,-17.26,;13.14,-14.71,;14.6,-15.17,;15.08,-16.63,;16.62,-16.63,;17.08,-15.16,;15.84,-14.27,;15.83,-12.74,;17.16,-11.97,;14.5,-11.97,;14.5,-10.44,;15.83,-9.66,;15.82,-8.13,;14.49,-7.37,;13.17,-8.14,;13.17,-9.67,;14.49,-5.83,;15.83,-5.06,;12.94,-5.83,;13.71,-4.49,;18.62,-15.16,;19.38,-13.83,;18.6,-12.49,;20.92,-13.82,;21.7,-15.16,;20.94,-16.49,;19.39,-16.5,;18.62,-17.84,)| | ||
| Structure | 
| ||