Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50052738
Substrate
n/a
Meas. Tech.
ChEMBL_159317 (CHEMBL769370)
IC50
0.3±n/a nM
Citation
 Kim, CUMcGee, LRKrawczyk, SHHarwood, EHarada, YSwaminathan, SBischofberger, NChen, MSCherrington, JMXiong, SFGriffin, LCundy, KCLee, AYu, BGulnik, SErickson, JW New series of potent, orally bioavailable, non-peptidic cyclic sulfones as HIV-1 protease inhibitors. J Med Chem 39:3431-4 (1996) [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:
BDBM50052738
Synonyms:
(2R,3R,4R,5R,6R,7R)-2,7-Dibenzyl-1,1-dioxo-3,6-bis-(thiazol-5-ylmethoxy)-1lambda*6*-thiepane-4,5-diol | CHEMBL326764
Type:
Small organic molecule
Emp. Form.:
C28H30N2O6S3
Mol. Mass.:
586.743
SMILES:
O[C@@H]1[C@@H](O)[C@@H](OCc2cncs2)[C@@H](Cc2ccccc2)S(=O)(=O)[C@H](Cc2ccccc2)[C@@H]1OCc1cncs1
Structure:
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