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Target
HIV-1 protease
Ligand
BDBM50479738
Substrate
n/a
Meas. Tech.
ChEMBL_517306 (CHEMBL1031359)
Ki
0.014000±n/a nM
Citation
 Jorissen, RN; Reddy, GS; Ali, A; Altman, MD; Chellappan, S; Anjum, SG; Tidor, B; Schiffer, CA; Rana, TM; Gilson, MK Additivity in the analysis and design of HIV protease inhibitors. J Med Chem 52:737-54 (2009) [PubMed]  Article 
Target
Name:
HIV-1 protease
Synonyms:
HIV-1 | HIV-1 protease | protease
Type:
PROTEIN
Mol. Mass.:
10795.19
Organism:
Human immunodeficiency virus
Description:
ChEMBL_118439
Residue:
99
Sequence:
PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYDQILIEICGHKAIGTVLIGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50479738
Synonyms:
CHEMBL514810
Type:
Small organic molecule
Emp. Form.:
C29H40N4O5S2
Mol. Mass.:
588.782
SMILES:
CCCCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(C)=O)C(C)C)S(=O)(=O)c1ccc2ncsc2c1 |r|
Structure:
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