Reaction Details Report a problem with these data
Target
Protease
Ligand
BDBM50478563
Substrate
n/a
Meas. Tech.
ChEMBL_483709 (CHEMBL954608)
IC50
6000±n/a nM
Citation
 Patil, AD; Kokke, WC; Cochran, S; Francis, TA; Tomszek, T; Westley, JW Brominated polyacetylenic acids from the marine sponge Xestospongia muta: inhibitors of HIV protease. J Nat Prod 55:1170-7 (1992) [PubMed]  Article 
Target
Name:
Protease
Synonyms:
n/a
Type:
Enzyme
Mol. Mass.:
10904.79
Organism:
Human immunodeficiency virus 1 (HIV-1)
Description:
Q9YQ12
Residue:
99
Sequence:
PQITLWQRPFVTIKIEGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYDQIVIEICGKKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50478563
Synonyms:
CHEMBL450380
Type:
Small organic molecule
Emp. Form.:
C18H17BrO2
Mol. Mass.:
345.23
SMILES:
OC(=O)CCCC#CC#C\C=C\CC\C=C\C#C\C=C\Br
Structure:
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