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. 2023 Apr 28;13:6972. doi: 10.1038/s41598-023-33024-2

Table 1.

Number of pharmacophore-matching compounds identified per database screened.

Chemical databases screened Number of generated pharmacophore-matching compounds
CHEMBL30 3003
ChemDiv 3728
ChemSpace 9428
MCULE 30,283
MCULE-ULTIMATE 21,373
MolPort 8781
NCI Open Chemistry Repository 8
WuXi LabNetwork 3495
ZINC 11,186
Cumulative 91,285