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AI model aims to predict how medicines taste

22 September 2023

A team from the 果冻影院 Global Business School for Health (GBSH) and the 果冻影院 School of Pharmacy are using data collected from an 鈥渆lectric tongue鈥 to create an AI model for predicting the bitterness of drugs.

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Taste is key to making sure people regularly take their medications and is an important part of drug development. For example, taste has been identified as the biggest barrier in compliance for children taking medicine, but taste is also an issue for adults, especially adults taking long-term medication, such as for HIV.

A research team led by Dr Hend Abdelhakim (果冻影院 Global Business School for Health) used an e-tongue (a device made of sensors responding to taste) to assign bitterness scores to medicines, and in turn estimate the aversiveness expected from the clinical dose planned.

The e-tongue measures how much the bitter molecules stick on a plastic sensor that acts like the human tongue, and then it compares it with a clear sample. The difference between the two measurements represents a theoretical bitterness level of a medicine.

Using an e-tongue means drugs can be tested more quickly and effectively compared to the alternative option of conducting a human trial, but now the team are collaborating with machine learning experts including Dr David Shorthouse (果冻影院 School of Pharmacy) to speed up drug development further using an AI model.

Using data from the e-tongue, the AI model breaks down a drug into a series of molecular descriptors (e.g., number of atoms, total surface area of the molecule) that determine taste in order to predict levels of bitterness.

The model being developed will be an open access tool, meaning that pharmaceutical development around the world can benefit from the data on palatability of medicines.

Dr Abdelhakim told the Telegraph: 鈥We run a machine learning algorithm to basically see what鈥檚 the chemical structure,听what鈥檚 the molecular structure, what are the other chemical physical parameters that make it bitter, and try to see if there鈥檚 a relationship.鈥

Dr Abdelhakim explained that taste in medicines was especially a problem for children who have a 鈥渉eightened sense of taste鈥.

鈥淚t鈥檚 a problem for longer term diseases, so for example, HIV,鈥 explained Dr Abdelhakim. 鈥淎ntiretroviral medicines don鈥檛 taste very well. So, if the patient has to take those pills every day for life, it鈥檚 a much bigger problem, especially if they start them very, very young.

鈥淓ven if it鈥檚 a wonder drug, if the patient doesn鈥檛 take it, it won鈥檛 work.鈥

Treatment adherence is also particularly important with antibiotics as an interrupted course of treatment will contribute to antimicrobial resistance.听

鈥淲ith antibiotics, if the patient doesn鈥檛 take it, yes, they won鈥檛 get better. But also you鈥檙e going to contribute to antimicrobial resistance,鈥 said Dr Abdelhakim. 鈥淚t鈥檚 actually a bigger problem for the rest of us.鈥

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Media contact

Mark Greaves

E: m.greaves [at] ucl.ac.uk