Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50282526
Substrate
n/a
Meas. Tech.
ChEMBL_79795 (CHEMBL696055)
IC50
4±n/a nM
Citation
 Dorsselaer, VV; Schirlin, D; Tarnus, C; Taylor, DL; Tyms, AS; Weber, F; Baltzer, S; Remy, JM; Brennan, T; Janowick, D Increased antiviral activity of HIV protease inhibitors of the difluorostatone type bearing (R)-valinol derivatives as novel c-termini Bioorg Med Chem Lett 4:1213-1218 (1994)    Article 
Target
Name:
Gag-Pol polyprotein [489-587]
Synonyms:
Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol
Type:
Enzyme Subunit
Mol. Mass.:
10781.16
Organism:
Human immunodeficiency virus type 1
Description:
P04585[489-587]
Residue:
99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50282526
Synonyms:
CHEMBL20642 | {(S)-1-[1-(4-Benzyloxy-benzyl)-3,3-difluoro-3-(1-formyl-2-methyl-propylcarbamoyl)-2-oxo-propylcarbamoyl]-2-methyl-propyl}-carbamic acid benzyl ester
Type:
Small organic molecule
Emp. Form.:
C36H41F2N3O7
Mol. Mass.:
665.7234
SMILES:
CC(C)C(NC(=O)C(F)(F)C(=O)C(Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@@H](NC(=O)OCc1ccccc1)C(C)C)C=O
Structure:
Search PDB for entries with ligand similarity: