Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50009241
Substrate
n/a
Meas. Tech.
ChEMBL_157875 (CHEMBL763270)
Ki
0.040000±n/a nM
Citation
 Huff, JR HIV protease: a novel chemotherapeutic target for AIDS. J Med Chem 34:2305-14 (1991) [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:
BDBM50009241
Synonyms:
1-[1-[1-aminobutyloxycarbonyl-2-methyl-(1S)-propylcarboxamido]-2-methyl-(1S)-propylcarboxamido]-2-phenyl-(1S)-ethyl{2-[1-[1-carbamoyl-2-methyl-(1S)-propylcarbamoyl]-2-methyl-(1S)-propylcarbamoyl]-3-phenylpropyl}phosphinic acid | CHEMBL74041
Type:
Small organic molecule
Emp. Form.:
C43H67N6O9P
Mol. Mass.:
843.0006
SMILES:
CC(C)[C@H](NC(=O)[C@@H](NC(=O)C(Cc1ccccc1)CP(O)(=O)[C@@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)C)C(C)C)C(C)C)C(N)=O
Structure:
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