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Target
Protease
Ligand
BDBM50483339
Substrate
n/a
Meas. Tech.
ChEMBL_715372 (CHEMBL1664701)
Ki
5.3±n/a nM
Citation
 Ghosh, AK; Chapsal, BD; Baldridge, A; Steffey, MP; Walters, DE; Koh, Y; Amano, M; Mitsuya, H Design and synthesis of potent HIV-1 protease inhibitors incorporating hexahydrofuropyranol-derived high affinity P(2) ligands: structure-activity studies and biological evaluation. J Med Chem 54:622-34 (2011) [PubMed]  Article 
Target
Name:
Protease
Synonyms:
n/a
Type:
Enzyme
Mol. Mass.:
10904.79
Organism:
Human immunodeficiency virus 1 (HIV-1)
Description:
Q9YQ12
Residue:
99
Sequence:
PQITLWQRPFVTIKIEGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYDQIVIEICGKKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
  
Inhibitor
Name:
BDBM50483339
Synonyms:
CHEMBL1651158
Type:
Small organic molecule
Emp. Form.:
C29H40N2O8S
Mol. Mass.:
576.701
SMILES:
[H][C@]12COC[C@@]1([H])[C@H](CCO2)OC(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(CC(C)C)S(=O)(=O)c1ccc(OC)cc1 |r|
Structure:
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