Reaction Details Report a problem with these data
Target
Endothelin-1 receptor
Ligand
BDBM50288555
Substrate
n/a
Meas. Tech.
ChEMBL_65478 (CHEMBL873600)
IC50
>25000±n/a nM
Citation
 Cheng, XM; Lee, C; Klutchko, S; Winters, T; Reynolds, EE; Welch, KM; Flynn, MA; Doherty, AM Synthesis and structure-activity relationships of 9-substituted acridines as endothelin-A receptor antagonists Bioorg Med Chem Lett 6:2999-3002 (1996)    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:
BDBM50288555
Synonyms:
Acridin-9-yl-benzo[1,3]dioxol-5-yl-acetic acid 4-tert-butyl-benzyl ester | CHEMBL319679
Type:
Small organic molecule
Emp. Form.:
C33H29NO4
Mol. Mass.:
503.5877
SMILES:
CC(C)(C)c1ccc(COC(=O)C(c2ccc3OCOc3c2)c2c3ccccc3nc3ccccc23)cc1
Structure:
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