Reaction Details Report a problem with these data
Target
Endothelin-1 receptor
Ligand
BDBM50291502
Substrate
n/a
Meas. Tech.
ChEBML_65629
IC50
218±n/a nM
Citation
 Raju, B; Okun, I; Stavros, F; Chan, MF Amide bond surrogates: A study in thiophenesulfonamide based endothelin receptor antagonists Bioorg Med Chem Lett 7:939-944 (1997)    Article 
Target
Name:
Endothelin-1 receptor
Synonyms:
EDNRA | EDNRA_HUMAN | ET-A | ETA | ETA-R | ETRA | Endothelin receptor type A | Endothelin receptor, ET-A/ET-B | hET-AR
Type:
Enzyme Catalytic Domain
Mol. Mass.:
48736.88
Organism:
Homo sapiens (Human)
Description:
P25101
Residue:
427
Sequence:
METLCLRASFWLALVGCVISDNPERYSTNLSNHVDDFTTFRGTELSFLVTTHQPTNLVLPSNGSMHNYCPQQTKITSAFKYINTVISCTIFIVGMVGNATLLRIIYQNKCMRNGPNALIASLALGDLIYVVIDLPINVFKLLAGRWPFDHNDFGVFLCKLFPFLQKSSVGITVLNLCALSVDRYRAVASWSRVQGIGIPLVTAIEIVSIWILSFILAIPEAIGFVMVPFEYRGEQHKTCMLNATSKFMEFYQDVKDWWLFGFYFCMPLVCTAIFYTLMTCEMLNRRNGSLRIALSEHLKQRREVAKTVFCLVVIFALCWFPLHLSRILKKTVYNEMDKNRCELLSFLLLMDYIGINLATMNSCINPIALYFVSKKFKNCFQSCLCCCCYQSKSLMTSVPMNGTSIQWKNHDQNNHNTDRSSHKDSMN
  
Inhibitor
Name:
BDBM50291502
Synonyms:
3-(2-Benzo[1,3]dioxol-5-yl-vinyl)-thiophene-2-sulfonic acid (4-bromo-3-methyl-isoxazol-5-yl)-amide | CHEMBL174363
Type:
Small organic molecule
Emp. Form.:
C17H13BrN2O5S2
Mol. Mass.:
469.33
SMILES:
Cc1noc(NS(=O)(=O)c2sccc2\C=C\c2ccc3OCOc3c2)c1Br
Structure:
Search PDB for entries with ligand similarity: