Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50073369
Substrate
n/a
Meas. Tech.
ChEBML_157552
Ki
17±n/a nM
Citation
 Salituro, FG; Baker, CT; Court, JJ; Deininger, DD; Kim, EE; Li, B; Novak, PM; Rao, BG; Pazhanisamy, S; Porter, MD; Schairer, WC; Tung, RD Design and synthesis of novel conformationally restricted HIV protease inhibitors. Bioorg Med Chem Lett 8:3637-42 (1999) [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:
BDBM50073369
Synonyms:
CHEMBL433187 | N-[(S)-3-((S)-3-Benzyl-5-oxo-1,4-diaza-spiro[5.5]undec-4-yl)-2-hydroxy-propyl]-N-cyclopentylmethyl-4-methoxy-benzenesulfonamide
Type:
Small organic molecule
Emp. Form.:
C32H45N3O5S
Mol. Mass.:
583.782
SMILES:
COc1ccc(cc1)S(=O)(=O)N(C[C@@H](O)CN1[C@@H](Cc2ccccc2)CNC2(CCCCC2)C1=O)CC1CCCC1
Structure:
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