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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50041047
Substrate
n/a
Meas. Tech.
ChEMBL_159300 (CHEMBL769406)
IC50
590±n/a nM
Citation
 Greer, J; Erickson, JW; Baldwin, JJ; Varney, MD Application of the three-dimensional structures of protein target molecules in structure-based drug design. J Med Chem 37:1035-54 (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:
BDBM50041047
Synonyms:
2-Amino-N-[(1S,3S)-3-(2-amino-3-methyl-butyrylamino)-1-benzyl-2-hydroxy-4-phenyl-butyl]-3-methyl-butyramide | CHEMBL273367
Type:
Small organic molecule
Emp. Form.:
C27H40N4O3
Mol. Mass.:
468.6315
SMILES:
CC(C)C(N)C(=O)N[C@@H](Cc1ccccc1)C(O)[C@H](Cc1ccccc1)NC(=O)C(N)C(C)C
Structure:
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