Users can draw a structure online, input or upload structures in SMILES format to conveniently predict
the inhibitory activity and selectivity of molecules against five major CYP isoforms (e.g., CYP1A2,
CYP2C19, CYP2C9, CYP2D6, and CYP3A4).
The DEEPCYPs online platform can promote the prediction of drug-drug interactions in clinical practice
and could be used to rule out inappropriate compounds in the early stages of drug discovery and/or
identify new CYPs inhibitors.