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Fig. 4 | Journal of Cheminformatics

Fig. 4

From: Predicting drug–drug interactions through drug structural similarities and interaction networks incorporating pharmacokinetics and pharmacodynamics knowledge

Fig. 4

Example of a network examining relationship between two drugs (Dq and De). Dq: a query drug, for which potential DDIs are predicted with a drug under examination, De; T1: a target protein for De (source DrugBank); P1, P2: proteins that have physical interactions with T1 (source BioGRID); E1, E2: enzymes of De (source DrugBank); Tr1, Tr2: transporters of De (source DrugBank); D1 through D12: drugs associating with the proteins including T1, P1, P2, E1, E2, Tr1, and Tr2 in the network; protein–protein interaction (source BioGRID): purple line; pharmacogenetic association (source PharmGKB): blue line; PK-related interaction (source DrugBank): brown line; drug-target interaction (source DrugBank): green line. Sd, Se1, Se2, Se3, Seg1, Str1, Str2, Strg1, Sta1, Sta2, Sta3, Stag1, Stag2: similarity scores between Dq and drugs in De’s network (D1 through D12)

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