Reaction Details Report a problem with these data
Target
Carbonic anhydrase 12
Ligand
BDBM50515802
Substrate
n/a
Meas. Tech.
ChEMBL_1862694 (CHEMBL4363550)
Ki
0.880000±n/a nM
Citation
 Moi, D; Nocentini, A; Deplano, A; Balboni, G; Supuran, CT; Onnis, V Structure-activity relationship with pyrazoline-based aromatic sulfamates as carbonic anhydrase isoforms I, II, IX and XII inhibitors: Synthesis and biological evaluation. Eur J Med Chem 182:0 (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:
BDBM50515802
Synonyms:
CHEMBL4456443
Type:
Small organic molecule
Emp. Form.:
C17H16N4O6S
Mol. Mass.:
404.397
SMILES:
CC(=O)N1N=C(CC1c1ccc(OS(N)(=O)=O)cc1)c1ccc(cc1)[N+]([O-])=O |c:4|
Structure:
Search PDB for entries with ligand similarity: