Reaction Details Report a problem with these data
Target
Carbonic anhydrase 12
Ligand
BDBM50508840
Substrate
n/a
Meas. Tech.
ChEMBL_1834733 (CHEMBL4334866)
Ki
0.560000±n/a nM
Citation
 Mujumdar, P; Kopecka, J; Bua, S; Supuran, CT; Riganti, C; Poulsen, SA Carbonic Anhydrase XII Inhibitors Overcome Temozolomide Resistance in Glioblastoma. J Med Chem 62:4174-4192 (2019) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 12
Synonyms:
CA-XII | CA12 | CAH12_HUMAN | Carbonate dehydratase XII | Carbonic anhydrase | Carbonic anhydrase 12 (CA XII) | Carbonic anhydrase XII | Carbonic anhydrase XII (CA XII) | Carbonic anhydrase XII (CAXII) | Tumor antigen HOM-RCC-3.1.3
Type:
Enzyme
Mol. Mass.:
39456.00
Organism:
Homo sapiens (Human)
Description:
Catalytic domain of human cloned isozyme was used in the assay
Residue:
354
Sequence:
MPRRSLHAAAVLLLVILKEQPSSPAPVNGSKWTYFGPDGENSWSKKYPSCGGLLQSPIDLHSDILQYDASLTPLEFQGYNLSANKQFLLTNNGHSVKLNLPSDMHIQGLQSRYSATQLHLHWGNPNDPHGSEHTVSGQHFAAELHIVHYNSDLYPDASTASNKSEGLAVLAVLIEMGSFNPSYDKIFSHLQHVKYKGQEAFVPGFNIEELLPERTAEYYRYRGSLTTPPCNPTVLWTVFRNPVQISQEQLLALETALYCTHMDDPSPREMINNFRQVQKFDERLVYTSFSQVQVCTAAGLSLGIILSLALAGILGICIVVVVSIWLFRRKSIKKGDNKGVIYKPATKMETEAHA
  
Inhibitor
Name:
BDBM50508840
Synonyms:
CHEMBL4461878
Type:
Small organic molecule
Emp. Form.:
C11H11N5O4S2
Mol. Mass.:
341.366
SMILES:
NS(=O)(=O)c1nnc(NC(=O)C(\Cc2ccccc2)=N\O)s1
Structure:
Search PDB for entries with ligand similarity: