Reaction Details Report a problem with these data
Target
Carbonic anhydrase 1
Ligand
BDBM50429899
Substrate
n/a
Meas. Tech.
ChEMBL_1673905 (CHEMBL4023934)
KOFF
0.000027 s-1
Citation
 Linkuvien?, V; Talibov, VO; Danielson, UH; Matulis, D Introduction of Intrinsic Kinetics of Protein-Ligand Interactions and Their Implications for Drug Design. J Med Chem 61:2292-2302 (2018) [PubMed]  Article 
Target
Name:
Carbonic anhydrase 1
Synonyms:
4.2.1.1 | CA-I | CA1 | CAH1_MACMU | Carbonate dehydratase I | Carbonic anhydrase 1 | Carbonic anhydrase I
Type:
PROTEIN
Mol. Mass.:
28941.00
Organism:
Macaca mulatta
Description:
ChEMBL_117334
Residue:
261
Sequence:
MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSEAKHDTSLKPISVSYNPATAKEIINVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSSNEYGSEHTVDGVKYSSELHIVHWNSAKYSSLAEAVSKADGLAVIGVLMKVGEANPKLQKVLDALHAIKTKGKRAPFTNFDPSTLLPSSLDFWTYSGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGSNPVPIQRNNRPTQPLKGRTVRASF
  
Inhibitor
Name:
BDBM50429899
Synonyms:
CHEMBL2333416
Type:
Small organic molecule
Emp. Form.:
C8H7F4NO3S2
Mol. Mass.:
305.27
SMILES:
NS(=O)(=O)c1c(F)c(F)c(SCCO)c(F)c1F
Structure:
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