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TargetProtease
LigandBDBM50484841
Substrate/Competitorn/a
Meas. Tech.ChEMBL_807142 (CHEMBL1959806)
Ki 0.0075±n/a nM
Citation Ghosh, AKChapsal, BDSteffey, MAgniswamy, JWang, YFAmano, MWeber, ITMitsuya, H Substituent effects on P2-cyclopentyltetrahydrofuranyl urethanes: design, synthesis, and X-ray studies of potent HIV-1 protease inhibitors. Bioorg Med Chem Lett22:2308-11 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Protease
Name:Protease
Synonyms:n/a
Type:Enzyme
Mol. Mass.:10904.79
Organism:Human immunodeficiency virus 1 (HIV-1)
Description:Q9YQ12
Residue:99
Sequence:
PQITLWQRPFVTIKIEGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYD
QIVIEICGKKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50484841
n/a
NameBDBM50484841
Synonyms:CHEMBL1958481
TypeSmall organic molecule
Emp. Form.C31H43N3O8S
Mol. Mass.617.753
SMILES[H][C@@]12C[C@@H](C[C@]1([H])[C@H](CO2)NC(C)=O)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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