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Target
Carbonic anhydrase 1
Ligand
BDBM50567598
Substrate
n/a
Meas. Tech.
ChEMBL_2103534 (CHEMBL4812037)
Ki
93±n/a nM
Citation
 Elbadawi, MM; Eldehna, WM; Nocentini, A; Abo-Ashour, MF; Elkaeed, EB; Abdelgawad, MA; Alharbi, KS; Abdel-Aziz, HA; Supuran, CT; Gratteri, P; Al-Sanea, MM Identification of N-phenyl-2-(phenylsulfonyl)acetamides/propanamides as new SLC-0111 analogues: Synthesis and evaluation of the carbonic anhydrase inhibitory activities. Eur J Med Chem 218:0 (2021) [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:
BDBM50567598
Synonyms:
CHEMBL4853209
Type:
Small organic molecule
Emp. Form.:
C15H16N2O5S2
Mol. Mass.:
368.428
SMILES:
CC(C(=O)Nc1ccc(cc1)S(N)(=O)=O)S(=O)(=O)c1ccccc1
Structure:
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