Skip to contents

A data.table containing drug identifiers and their corresponding names.

Usage

drug_annot

Format

A data.table with the following columns:

drug_id

A character vector representing the drug identifier.

drug_name

A character vector representing the name of the drug.

Source

The drug annotations were obtained from ChEMBL, DrugBank, and CTD.

Details

The `drug_annot` data set provides a mapping between drug identifiers and their corresponding names. Each row represents a unique drug identifier (`drug_id`) and its associated name (`drug_name`).

The drug identifiers and names in this data set are sourced from ChEMBL, DrugBank, and CTD to extract synonyms for the same drug.

Examples

library(labyrinth)

data(drug_annot, package = "labyrinth")

# Access drug names for specific identifiers
drug_annot[drug_annot$drug_id == "2838", ]$drug_name  # Imatinib
#>  [1] "ALPHA-(4-METHYL-1-PIPERAZINYL)-3'-((4-(3-PYRIDYL)-2-PYRIMIDINYL)AMINO)-P-TOLU-P-TOLUIDIDE"
#>  [2] "CELONIB"                                                                                  
#>  [3] "CGP 57148"                                                                                
#>  [4] "CGP-57148"                                                                                
#>  [5] "CGP57148"                                                                                 
#>  [6] "CGP57148B"                                                                                
#>  [7] "D01441"                                                                                   
#>  [8] "ENLIVEN"                                                                                  
#>  [9] "GLAMOX"                                                                                   
#> [10] "GLEEVEC"                                                                                  
#> [11] "GLIVEC"                                                                                   
#> [12] "IMATIB"                                                                                   
#> [13] "IMATINIB"                                                                                 
#> [14] "IMATINIB MESILATE"                                                                        
#> [15] "IMATINIB MESYLATE"                                                                        
#> [16] "IMATINIB METHANESULFONATE"                                                                
#> [17] "MESYLATE, IMATINIB"                                                                       
#> [18] "MESYLONIB"                                                                                
#> [19] "METHANESULFONATE, IMATINIB"                                                               
#> [20] "MITINAB"                                                                                  
#> [21] "NSC-716051"                                                                               
#> [22] "PLIVATINIB"                                                                               
#> [23] "QTI-571"                                                                                  
#> [24] "QTI571"                                                                                   
#> [25] "SHANTINIB"                                                                                
#> [26] "ST 1571"                                                                                  
#> [27] "ST1571"                                                                                   
#> [28] "STI 571"                                                                                  
#> [29] "STI-571"                                                                                  
#> [30] "STI571"                                                                                   
#> [31] "CHEMBL1642"                                                                               
#> [32] "CHEMBL941"                                                                                
#> [33] "DB00619"                                                                                  

# Count the number of unique drugs
length(unique(drug_annot$drug_id))
#> [1] 16716

# Visualize the data
drug_id <- drug_annot$drug_id
hist(table(drug_id))