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Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50037540
Substrate
n/a
Meas. Tech.
ChEMBL_159296 (CHEMBL763336)
IC50
0.810000±n/a nM
Citation
 Dorsey, BD; Levin, RB; McDaniel, SL; Vacca, JP; Guare, JP; Darke, PL; Zugay, JA; Emini, EA; Schleif, WA; Quintero, JC L-735,524: the design of a potent and orally bioavailable HIV protease inhibitor. J Med Chem 37:3443-51 (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:
BDBM50037540
Synonyms:
CHEMBL115176 | {(S)-3-tert-Butylcarbamoyl-4-[(2S,4R)-2-hydroxy-4-((R)-(R)-2-hydroxy-indan-1-ylcarbamoyl)-5-phenyl-pentyl]-piperazin-1-yl}-acetic acid tert-butyl ester
Type:
Small organic molecule
Emp. Form.:
C36H52N4O6
Mol. Mass.:
636.8213
SMILES:
CC(C)(C)NC(=O)[C@@H]1CN(CC(=O)OC(C)(C)C)CCN1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)NC1[C@H](O)Cc2ccccc12
Structure:
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