Reaction Details Report a problem with these data
Target
Carbonic anhydrase
Ligand
BDBM50158518
Substrate
n/a
Meas. Tech.
ChEMBL_1566139 (CHEMBL3787808)
Ki
37±n/a nM
Citation
 Akdemir, A; Güzel-Akdemir, Ö; Karali, N; Supuran, CT Isatin analogs as novel inhibitors of Candida spp.ß-carbonic anhydrase enzymes. Bioorg Med Chem 24:1648-52 (2016) [PubMed]  Article 
Target
Name:
Carbonic anhydrase
Synonyms:
n/a
Type:
PROTEIN
Mol. Mass.:
24709.64
Organism:
Candida glabrata
Description:
ChEMBL_584597
Residue:
219
Sequence:
MTKDTIFTLTGKCALDNILDANRQWAQAMHRSQPQLFPTNGQGQDPHTLFIGCSDSRYNEDCLGVLPGEIFTLKTVANICHTDDHSLLATLEFAILNLKVNRIILCGHTDCGGIKTCLLGRESIKESCPHLYEHLDDIEDLVESHESELNQLDNICSKSKLMSHRNVERQLQRLLQIPVVQDALRNSNQDHEFNIFGLVYNVDSGLVDVVREVYGNQQK
  
Inhibitor
Name:
BDBM50158518
Synonyms:
CHEMBL3786062
Type:
Small organic molecule
Emp. Form.:
C15H12BrN3O3S
Mol. Mass.:
394.243
SMILES:
CN1C(=O)\C(=N/c2ccc(cc2)S(N)(=O)=O)c2cc(Br)ccc12
Structure:
Search PDB for entries with ligand similarity: