Reaction Details Report a problem with these data
Target
Carbonic anhydrase 2
Ligand
BDBM50567602
Substrate
n/a
Meas. Tech.
ChEMBL_2103535 (CHEMBL4812038)
Ki
31700±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 2
Synonyms:
CA-II | CA2 | CAC | CAH2_HUMAN | Carbonate dehydratase II | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase 2 (CA-II) | Carbonic anhydrase 2 (Recombinant CA II) | Carbonic anhydrase C | Carbonic anhydrase II (CA II) | Carbonic anhydrase II (CA-II) | Carbonic anhydrase II (CAII) | Carbonic anhydrase II (hCA II) | Carbonic anhydrase isoenzyme II (hCA II)
Type:
Enzyme
Mol. Mass.:
29250.71
Organism:
Homo sapiens (Human)
Description:
P00918
Residue:
260
Sequence:
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
  
Inhibitor
Name:
BDBM50567602
Synonyms:
CHEMBL4856530
Type:
Small organic molecule
Emp. Form.:
C15H13NO5S
Mol. Mass.:
319.332
SMILES:
OC(=O)c1ccc(NC(=O)CS(=O)(=O)c2ccccc2)cc1
Structure:
Search PDB for entries with ligand similarity: