Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50037529
Substrate
n/a
Meas. Tech.
ChEMBL_159296 (CHEMBL763336)
IC50
0.300000±n/a nM
Citation
 Dorsey, BDLevin, RBMcDaniel, SLVacca, JPGuare, JPDarke, PLZugay, JAEmini, EASchleif, WAQuintero, JC L-735,524: the design of a potent and orally bioavailable HIV protease inhibitor. J Med Chem 37:3443-51 (1994) [PubMed]  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:
BDBM50037529
Synonyms:
(S)-4-Benzyl-1-[(2S,4R)-2-hydroxy-4-((R)-(R)-2-hydroxy-indan-1-ylcarbamoyl)-5-phenyl-pentyl]-piperazine-2-carboxylic acid tert-butylamide | CHEMBL324084
Type:
Small organic molecule
Emp. Form.:
C37H48N4O4
Mol. Mass.:
612.8014
SMILES:
CC(C)(C)NC(=O)[C@@H]1CN(Cc2ccccc2)CCN1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)NC1[C@H](O)Cc2ccccc12
Structure:
Search PDB for entries with ligand similarity: