Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50037538
Substrate
n/a
Meas. Tech.
ChEMBL_159296 (CHEMBL763336)
IC50
0.310000±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
More Info.:
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:
BDBM50037538
Synonyms:
(S)-4-(2,4-Difluoro-benzyl)-1-[(2S,4R)-2-hydroxy-4-((R)-(R)-2-hydroxy-indan-1-ylcarbamoyl)-5-phenyl-pentyl]-piperazine-2-carboxylic acid tert-butylamide | CHEMBL326543
Type:
Small organic molecule
Emp. Form.:
C37H46F2N4O4
Mol. Mass.:
648.7823
SMILES:
CC(C)(C)NC(=O)[C@@H]1CN(Cc2ccc(F)cc2F)CCN1C[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)NC1[C@H](O)Cc2ccccc12