Reaction Details | |||
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Target | Carbonic anhydrase 12 | ||
Ligand | BDBM50500056 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1541758 (CHEMBL3745440) | ||
Ki | 7.0±n/a nM | ||
Citation | Carta, F; Ferraroni, M; Scozzafava, A; Supuran, CT Fluorescent sulfonamide carbonic anhydrase inhibitors incorporating 1,2,3-triazole moieties: Kinetic and X-ray crystallographic studies. Bioorg Med Chem24:104-12 (2016) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Carbonic anhydrase 12 | |||
Name: | Carbonic anhydrase 12 | ||
Synonyms: | CA-XII | CA12 | CAH12_HUMAN | Carbonate dehydratase XII | Carbonic anhydrase | Carbonic anhydrase 12 (CA XII) | Carbonic anhydrase XII | Carbonic anhydrase XII (CA XII) | Carbonic anhydrase XII (CAXII) | Tumor antigen HOM-RCC-3.1.3 | ||
Type: | Enzyme | ||
Mol. Mass.: | 39456.00 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Catalytic domain of human cloned isozyme was used in the assay | ||
Residue: | 354 | ||
Sequence: |
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BDBM50500056 | |||
n/a | |||
Name | BDBM50500056 | ||
Synonyms: | CHEMBL3741011 | ||
Type | Small organic molecule | ||
Emp. Form. | C28H21N3O7S2 | ||
Mol. Mass. | 575.612 | ||
SMILES | NS(=O)(=O)c1ccc(CNC(=S)Nc2ccc(c(c2)C(O)=O)-c2c3ccc(O)cc3oc3cc(=O)ccc23)cc1 |(-2.69,18.17,;-2.69,16.94,;-3.75,17.56,;-1.62,17.56,;-2.69,15.4,;-4.02,14.63,;-4.02,13.09,;-2.68,12.32,;-2.68,10.78,;-1.34,10.01,;-1.34,8.47,;-2.4,7.85,;-0,7.7,;0,6.16,;-1.33,5.39,;-1.33,3.85,;0,3.08,;1.34,3.85,;1.34,5.39,;2.67,3.09,;2.68,2.06,;3.74,3.7,;,1.54,;-1.33,.77,;-2.67,1.54,;-4,.77,;-4,-.77,;-5.07,-1.39,;-2.67,-1.54,;-1.33,-.77,;,-1.54,;1.31,-.77,;2.67,-1.54,;4,-.77,;5.07,-1.39,;4,.77,;2.67,1.54,;1.31,.77,;-1.35,13.09,;-1.35,14.63,)| | ||
Structure |