Reaction Details |
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Target | Carbonic anhydrase 4 |
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Ligand | BDBM50208751 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_443317 (CHEMBL893565) |
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Ki | 43700±n/a nM |
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Citation | Winum, JY; Thiry, A; Cheikh, KE; Dogné, JM; Montero, JL; Vullo, D; Scozzafava, A; Masereel, B; Supuran, CT Carbonic anhydrase inhibitors. Inhibition of isoforms I, II, IV, VA, VII, IX, and XIV with sulfonamides incorporating fructopyranose-thioureido tails. Bioorg Med Chem Lett17:2685-91 (2007) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Carbonic anhydrase 4 |
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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: | MRMLLALLALSAARPSASAESHWCYEVQAESSNYPCLVPVKWGGNCQKDRQSPINIVTTK
AKVDKKLGRFFFSGYDKKQTWTVQNNGHSVMMLLENKASISGGGLPAPYQAKQLHLHWSD
LPYKGSEHSLDGEHFAMEMHIVHEKEKGTSRNVKEAQDPEDEIAVLAFLVEAGTQVNEGF
QPLVEALSNIPKPEMSTTMAESSLLDLLPKEEKLRHYFRYLGSLTTPTCDEKVVWTVFRE
PIQLHREQILAFSQKLYYDKEQTVSMKDNVRPLQQLGQRTVIKSGAPGRPLPWALPALLG
PMLACLLAGFLR
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BDBM50208751 |
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n/a |
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Name | BDBM50208751 |
Synonyms: | 1-(2-fluoro-4-sulfamoylphenyl)-3-{[(1R,2S,6S,9R)-4,4,11,11-tetramethyl-3,5,7,10,12-pentaoxatricyclo[7.3.0.0^{2,6}]dodecan-6-yl]methyl}thiourea | CHEMBL233019 |
Type | Small organic molecule |
Emp. Form. | C19H26FN3O7S2 |
Mol. Mass. | 491.554 |
SMILES | CC1(C)O[C@@H]2CO[C@@]3(CNC(=S)Nc4ccc(cc4F)S(N)(=O)=O)OC(C)(C)O[C@H]3[C@@H]2O1 |
Structure |
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