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Target
Carbonic anhydrase 1
Ligand
BDBM50535389
Substrate
n/a
Meas. Tech.
ChEMBL_1930328 (CHEMBL4433579)
Ki
19800±n/a nM
Citation
 Bonardi, A; Vermelho, AB; da Silva Cardoso, V; de Souza Pereira, MC; da Silva Lara, L; Selleri, S; Gratteri, P; Supuran, CT; Nocentini, A -Nitrosulfonamides as Carbonic Anhydrase Inhibitors: A Promising Chemotype for Targeting Chagas Disease and Leishmaniasis. ACS Med Chem Lett 10:413-418 (2019) [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:
BDBM50535389
Synonyms:
CHEMBL4545611
Type:
Small organic molecule
Emp. Form.:
C6H5AgN4O7S
Mol. Mass.:
385.06
SMILES:
[Ag;v0+].[#7]-c1cc(cc(c1-[#8])-[#7+](-[#8-])=O)S(=O)(=O)[#7-]-[#7+](-[#8-])=O
Structure:
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