Reaction Details Report a problem with these data
Target
Carbonic anhydrase 7
Ligand
BDBM50303499
Substrate
n/a
Meas. Tech.
ChEMBL_595956 (CHEMBL1044458)
Ki
2400±n/a nM
Citation
 Maresca, A; Temperini, C; Pochet, L; Masereel, B; Scozzafava, A; Supuran, CT Deciphering the mechanism of carbonic anhydrase inhibition with coumarins and thiocoumarins. J Med Chem 53:335-44 (2010) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 7
Synonyms:
CA-VII | CA7 | CAH7_HUMAN | Carbonate dehydratase VII | Carbonic anhydrase | Carbonic anhydrase VII | Carbonic anhydrase VII (CA VII)
Type:
Enzyme
Mol. Mass.:
29664.11
Organism:
Homo sapiens (Human)
Description:
Human cloned isozyme.
Residue:
264
Sequence:
MTGHHGWGYGQDDGPSHWHKLYPIAQGDRQSPINIISSQAVYSPSLQPLELSYEACMSLSITNNGHSVQVDFNDSDDRTVVTGGPLEGPYRLKQFHFHWGKKHDVGSEHTVDGKSFPSELHLVHWNAKKYSTFGEAASAPDGLAVVGVFLETGDEHPSMNRLTDALYMVRFKGTKAQFSCFNPKCLLPASRHYWTYPGSLTTPPLSESVTWIVLREPICISERQMGKFRSLLFTSEDDERIHMVNNFRPPQPLKGRVVKASFRA
  
Inhibitor
Name:
BDBM50303499
Synonyms:
7-(methyloxy)-2H-chromen-2-one | 7-Methoxycoumarin | 7-methoxy-2H-1-benzopyran-2-one | Ayapanin | CHEMBL49732 | Herniarin | Herniarine | Methylumbelliferone
Type:
Small organic molecule
Emp. Form.:
C10H8O3
Mol. Mass.:
176.1687
SMILES:
COc1ccc2ccc(=O)oc2c1
Structure:
Search PDB for entries with ligand similarity: