Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50037126
Substrate
n/a
Meas. Tech.
ChEBML_157883
Ki
92±n/a nM
Citation
Thompson, SK; Eppley, AM; Frazee, JS; Darcy, MG; Lum, RT; Tomaszek, TA; Ivanoff, LA; Morris, JF; Sternberg, EJ; Lambert, DM; Fernandez, AV; Petteway, SR; Meek, TD; Metcalf, BW; Gleason, JG Synthesis and antiviral activity of a novel class of HIV-1 protease inhibitors containing a heterocyclic P1-P2 amide bond isostere Bioorg Med Chem Lett 4:2441-2446 (1994) 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:
BDBM50037126
Synonyms:
CHEMBL80098 | [(1S,2S,4R)-1-Benzyl-2-hydroxy-5-phenyl-4-(5-propionyl-1H-imidazol-2-yl)-pentyl]-carbamic acid tert-butyl ester
Type:
Small organic molecule
Emp. Form.:
C29H37N3O4
Mol. Mass.:
491.6218
SMILES:
CCC(=O)c1cnc([nH]1)[C@@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)Cc1ccccc1