Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50284937
Substrate
n/a
Meas. Tech.
ChEMBL_159320 (CHEMBL769373)
IC50
40.0±n/a nM
Citation
Ahmad, S; Ashfaq, A; Alam, M; Bisacchi, GS; Chen, P; Cheng, PT; Greytok, JA; Hermsmeier, MA; Lin, PF; Lis, KA; Merchant, Z; Mitt, T; Skoog, M; Spergel, SH; Tino, JA; Vite, GD; Colonno, RJ; Zahler, R; Barrish, JC α-hydroxyamide derived aminodiols as potent inhibitors of hiv protease Bioorg Med Chem Lett 5:1729-1734 (1995) 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:
BDBM50284937
Synonyms:
CHEMBL45838 | {(1S,2R)-1-Benzyl-2-hydroxy-3-[(2R,3S)-2-hydroxy-4-phenyl-3-(3,3,3-trifluoro-2-hydroxy-propionylamino)-butylamino]-propyl}-carbamic acid tert-butyl ester
Type:
Small organic molecule
Emp. Form.:
C28H38F3N3O6
Mol. Mass.:
569.613
SMILES:
CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CNC[C@@H](O)[C@H](Cc1ccccc1)NC(=O)C(O)C(F)(F)F