Reaction Details Report a problem with these data
Target
Gag-Pol polyprotein [489-587]
Ligand
BDBM50576918
Substrate
n/a
Meas. Tech.
ChEMBL_2128491 (CHEMBL4837920)
Ki
2.6±n/a nM
Citation
 Zhu, M; Zhou, H; Ma, L; Dong, B; Zhou, J; Zhang, G; Wang, M; Wang, J; Cen, S; Wang, Y Design and evaluation of novel piperidine HIV-1 protease inhibitors with potency against DRV-resistant variants. Eur J Med Chem 220:0 (2021) [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:
BDBM50576918
Synonyms:
CHEMBL4877064
Type:
Small organic molecule
Emp. Form.:
C28H38F3N3O5S
Mol. Mass.:
585.679
SMILES:
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)OC[C@H]1CCCNC1)S(=O)(=O)c1ccc(cc1)C(F)(F)F |r|
Structure:
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