HIV Protein Inhibitor Prediction

HIV Protein Inhibitor Prediction

Welcome to HIVprotI. In this server, user can predict the IC50/Percent inhibition of given compounds against three HIV proteins namely reverse transcriptase, protease and integrase.You may chose to draw the structure or submit multiple compounds under batch mode. One can also generate analogs of query componds and predict their activity. In addition, a database of HIV inhibitors has also been provided. For more information click here.

  • HIVprotI is the first web server featuring regression based HIV protein inhibitor prediction algorithm.

  • Developed using inhibitors targeting reverse transcriptase, protease and integrase with experimentally proven IC50/percent inhibition.
  • SVM based models using inhibitor features, descriptors and fingerprints.

  • Highly user friendly web interface.

  • An option to draw inhibitor structure of desired specifications using sketch tool.

  • HIVprotI predictive scores output for all the models is provided against each protein alongwith different properties of the query molecule such as structure, charge, molecular weight, logP value, hydrogen and Lipinski bond donors/acceptors, rigid and rotatable bonds etc. to identify drug-like molecular structures.

  • HIVprotI would certainly be helpful to researchers working on anti-HIV therapeutics development.