Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50286998
Substrate
n/a
Meas. Tech.
ChEBML_159467
pH
4.7±n/a
IC50
15±n/a nM
Comments
extracted
Citation
 Steinbaugh, BA; Hamilton, HW; Prasad, JV; Para, KS; J., TP; Ferguson, D; Lunney, EA; Blankley, CJ A topliss tree analysis of the HIV-protease inhibitory activity of 6-phenyl-4-hydroxy-pyran-2-ones Bioorg Med Chem Lett 6:1099-1104 (1996)    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:
BDBM50286998
Synonyms:
6-(3,5-Dimethyl-phenyl)-4-hydroxy-3-(2-isopropyl-phenylsulfanyl)-pyran-2-one | CHEMBL276671
Type:
Small organic molecule
Emp. Form.:
C22H22O3S
Mol. Mass.:
366.473
SMILES:
CC(C)c1ccccc1Sc1c(O)cc(oc1=O)-c1cc(C)cc(C)c1
Structure:
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