Table 3.
‘Structure’ and ‘Role’ terms from Chemical Entities of Biological Interest (ChEBI) ontology associated with repositioned drugs
| ChEBI_ID | ChEBI_Name | P a | Adjusted P b | FC |
|---|---|---|---|---|
| CHEBI:19255 | Pyrimidine 2'-deoxyribonucleoside | 9.22E-06 | 1.36E-04 | 77.40 |
| CHEBI:23636 | Deoxyribonucleoside | 4.35E-09 | 1.41E-07 | 47.85 |
| CHEBI:33838 | Nucleoside | 2.18E-07 | 5.05E-06 | 10.70 |
| CHEBI:35789 | Oxo steroid | 8.48E-06 | 1.31E-04 | 8.03 |
| CHEBI:21731 | N-glycosyl compound | 7.69E-07 | 1.46E-05 | 7.83 |
| CHEBI:50996 | Tertiary amino compound | 2.55E-07 | 5.70E-06 | 7.68 |
| CHEBI:23132 | Chlorobenzenes | 1.60E-06 | 2.87E-05 | 6.36 |
| CHEBI:26912 | Oxolanes | 2.11E-05 | 2.89E-04 | 6.06 |
| CHEBI:29347 | Monocarboxylic acid amide | 1.60E-05 | 2.29E-04 | 5.53 |
| CHEBI:36684 | Organohalogen compound | 9.89E-14 | 9.14E-12 | 5.19 |
| CHEBI:68452 | Azole | 2.14E-05 | 2.89E-04 | 4.81 |
| CHEBI:22712 | Benzenes | 6.12E-08 | 1.52E-06 | 4.22 |
| CHEBI:50047 | Organic amino compound | 1.21E-13 | 9.82E-12 | 3.85 |
| CHEBI:25693 | Organic heteromonocyclic compound | 2.66E-10 | 1.11E-08 | 3.45 |
| CHEBI:33661 | Monocyclic compound | 2.74E-10 | 1.11E-08 | 3.44 |
| CHEBI:38101 | Organonitrogen heterocyclic compound | 1.01E-14 | 1.63E-12 | 3.07 |
| CHEBI:33833 | Heteroarene | 4.58E-07 | 9.27E-06 | 3.00 |
| CHEBI:33597 | Homocyclic compound | 2.63E-06 | 4.37E-05 | 2.80 |
| CHEBI:35352 | Organonitrogen compound | 1.17E-19 | 7.59E-17 | 2.41 |
| CHEBI:51143 | Nitrogen molecular entity | 3.15E-17 | 1.02E-14 | 2.15 |
| CHEBI:33659 | Organic aromatic compound | 3.70E-08 | 9.96E-07 | 2.09 |
| CHEBI:24532 | Organic heterocyclic compound | 9.89E-10 | 3.55E-08 | 2.04 |
| CHEBI:5686 | Heterocyclic compound | 1.20E-09 | 4.07E-08 | 2.03 |
| CHEBI:33832 | Organic cyclic compound | 9.14E-15 | 1.63E-12 | 1.94 |
| CHEBI:33595 | Cyclic compound | 2.10E-14 | 2.72E-12 | 1.92 |
| CHEBI:33302 | Pnictogen molecular entity | 5.00E-12 | 3.59E-10 | 1.77 |
| CHEBI:72695 | Organic molecule | 3.81E-11 | 2.24E-09 | 1.56 |
| CHEBI:25367 | Molecule | 6.17E-11 | 3.07E-09 | 1.55 |
| CHEBI:33285 | Heteroorganic entity | 5.23E-14 | 5.64E-12 | 1.47 |
Note. aBinomial test. bBenjamini–Hochberg test FC=fold-change.
*
Tested using 145 compounds in RepurposeDB mapped to ChEBI database.