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Target
Carbonic anhydrase 1
Ligand
BDBM50094392
Substrate
n/a
Meas. Tech.
ChEBML_47506
Ki
270±n/a nM
Citation
 Abbate, F; Casini, A; Owa, T; Scozzafava, A; Supuran, CT Carbonic anhydrase inhibitors: E7070, a sulfonamide anticancer agent, potently inhibits cytosolic isozymes I and II, and transmembrane, tumor-associated isozyme IX. Bioorg Med Chem Lett 14:217-23 (2003) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 1
Synonyms:
CA-I | CA1 | CAB | CAH1_HUMAN | Carbonate dehydratase I | Carbonic anhydrase | Carbonic anhydrase 1 (CA I) | Carbonic anhydrase 1 (CA-I) | Carbonic anhydrase 1 (Recombinant CA I) | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase B | Carbonic anhydrase I | Carbonic anhydrase I (CA I) | Carbonic anhydrase I (CA-I) | Carbonic anhydrase I (CAI) | Carbonic anhydrase I (hCA I) | Carbonic anhydrase isoenzyme I (hCA I) | hCA
Type:
Enzyme
Mol. Mass.:
28873.37
Organism:
Homo sapiens (Human)
Description:
P00915
Residue:
261
Sequence:
MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELHVAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNFDPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAVPMQHNNRPTQPLKGRTVRASF
  
Inhibitor
Name:
BDBM50094392
Synonyms:
2,3,4,5,6-Pentafluoro-N-(3-methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-2-ylidene)-benzamide | 2,3,4,5,6-Pentafluoro-N-[3-methyl-5-sulfamoyl-3H-[1,3,4]thiadiazol-(2E)-ylidene]-benzamide | CHEMBL69149
Type:
Small organic molecule
Emp. Form.:
C10H5F5N4O3S2
Mol. Mass.:
388.294
SMILES:
Cn1nc(s\c1=N\C(=O)c1c(F)c(F)c(F)c(F)c1F)S(N)(=O)=O
Structure:
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