Reaction Details Report a problem with these data
Target
Carbonic anhydrase 13
Ligand
BDBM50449818
Substrate
n/a
Meas. Tech.
ChEMBL_1816908 (CHEMBL4316482)
Kd
500±n/a nM
Citation
 Zakšauskas, A; Čapkauskaitė, E; Jezepčikas, L; Linkuvienė, V; Paketurytė, V; Smirnov, A; Leitans, J; Kazaks, A; Dvinskis, E; Manakova, E; Gražulis, S; Tars, K; Matulis, D Halogenated and di-substituted benzenesulfonamides as selective inhibitors of carbonic anhydrase isoforms. Eur J Med Chem 185:0 (2020) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 13
Synonyms:
Carbonic anhydrase XIII (CA XIII) | CAH13_HUMAN | CA13 | Carbonic anhydrase | Carbonic anhydrase 13 (CA XIII)
Type:
Enzyme
Mol. Mass.:
29445.78
Organism:
Human
Description:
Q8N1Q1
Residue:
262
Sequence:
MSRLSWGYREHNGPIHWKEFFPIADGDQQSPIEIKTKEVKYDSSLRPLSIKYDPSSAKIISNSGHSFNVDFDDTENKSVLRGGPLTGSYRLRQVHLHWGSADDHGSEHIVDGVSYAAELHVVHWNSDKYPSFVEAAHEPDGLAVLGVFLQIGEPNSQLQKITDTLDSIKEKGKQTRFTNFDLLSLLPPSWDYWTYPGSLTVPPLLESVTWIVLKQPINISSQQLAKFRSLLCTAEGEAAAFLVSNHRPPQPLKGRKVRASFH
  
Inhibitor
Name:
BDBM50449818
Synonyms:
CHEMBL4165896
Type:
Small organic molecule
Emp. Form.:
C12H14Cl2N2O5S
Mol. Mass.:
369.23
SMILES:
COC(=O)CCCNC(=O)c1cc(c(Cl)cc1Cl)S(N)(=O)=O
Structure:
Search PDB for entries with ligand similarity: