Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50040571
Substrate
n/a
Meas. Tech.
ChEMBL_159442 (CHEMBL763238)
IC50
63000±n/a nM
Citation
 De Voss, JJ; Sui, Z; DeCamp, DL; Salto, R; Babé, LM; Craik, CS; Ortiz de Montellano, PR Haloperidol-based irreversible inhibitors of the HIV-1 and HIV-2 proteases. J Med Chem 37:665-73 (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:
BDBM50040571
Synonyms:
1-Biphenyl-3-yl-4-[4-(4-chloro-phenyl)-4-hydroxy-piperidin-1-yl]-but-2-yn-1-one | CHEMBL159191
Type:
Small organic molecule
Emp. Form.:
C27H24ClNO2
Mol. Mass.:
429.938
SMILES:
OC1(CCN(CC#CC(=O)c2cccc(c2)-c2ccccc2)CC1)c1ccc(Cl)cc1
Structure:
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