import cando as cnd

cm = 'data/drugbank-v2.1-manuscript.tsv'
imw = 'data/indications-v2.1-coronavirus_actives.tsv'

cando = cnd.CANDO(cm, imw, read_dists='data/human-50th-pscore-v2.1-distances.tsv')
cando.canpredict_compounds('MESH:DOOOOOO', n=25, topX=115, consensus=True, keep_associated=True, save='3.5.20.similarity.txt')