PMC:7441777 / 31988-32893
Annnotations
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T199 | 209-212 | http://purl.obolibrary.org/obo/CLO_0009325 | denotes | TF1 |
T200 | 279-281 | http://purl.obolibrary.org/obo/CLO_0008922 | denotes | S2 |
T201 | 279-281 | http://purl.obolibrary.org/obo/CLO_0050052 | denotes | S2 |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T432 | 46-56 | Chemical | denotes | remdesivir | http://purl.obolibrary.org/obo/CHEBI_145994 |
T433 | 58-62 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
T434 | 64-67 | Chemical | denotes | TF3 | http://purl.obolibrary.org/obo/CHEBI_136608 |
T435 | 168-177 | Chemical | denotes | myricetin | http://purl.obolibrary.org/obo/CHEBI_18152|http://purl.obolibrary.org/obo/CHEBI_58395 |
T437 | 179-192 | Chemical | denotes | quercetagetin | http://purl.obolibrary.org/obo/CHEBI_8695 |
T438 | 194-204 | Chemical | denotes | hesperidin | http://purl.obolibrary.org/obo/CHEBI_28775 |
T439 | 261-271 | Chemical | denotes | remdesivir | http://purl.obolibrary.org/obo/CHEBI_145994 |
T440 | 279-281 | Chemical | denotes | S2 | http://purl.obolibrary.org/obo/CHEBI_29387 |
T441 | 336-346 | Chemical | denotes | polyphenol | http://purl.obolibrary.org/obo/CHEBI_26195 |
T442 | 347-350 | Chemical | denotes | TF3 | http://purl.obolibrary.org/obo/CHEBI_136608 |
T443 | 401-405 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
T444 | 431-441 | Chemical | denotes | inhibitors | http://purl.obolibrary.org/obo/CHEBI_35222 |
T445 | 476-479 | Chemical | denotes | TF3 | http://purl.obolibrary.org/obo/CHEBI_136608 |
T446 | 489-493 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
T447 | 503-513 | Chemical | denotes | remdesivir | http://purl.obolibrary.org/obo/CHEBI_145994 |
T448 | 515-518 | Chemical | denotes | TF3 | http://purl.obolibrary.org/obo/CHEBI_136608 |
T449 | 633-643 | Chemical | denotes | inhibitors | http://purl.obolibrary.org/obo/CHEBI_35222 |
T450 | 701-705 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
T451 | 829-833 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
777 | 69-73 | Gene | denotes | TF2b | Gene:2959 |
778 | 374-378 | Gene | denotes | RdRp | Gene:43740578 |
779 | 496-500 | Gene | denotes | TF2b | Gene:2959 |
780 | 542-546 | Gene | denotes | RdRp | Gene:43740578 |
781 | 684-688 | Gene | denotes | RdRp | Gene:43740578 |
782 | 709-713 | Gene | denotes | TF2b | Gene:2959 |
783 | 869-873 | Gene | denotes | TF2b | Gene:2959 |
784 | 46-56 | Chemical | denotes | remdesivir | MESH:C000606551 |
785 | 58-62 | Chemical | denotes | EGCG | MESH:C045651 |
786 | 168-177 | Chemical | denotes | myricetin | MESH:C040015 |
787 | 179-192 | Chemical | denotes | quercetagetin | MESH:C079163 |
788 | 194-204 | Chemical | denotes | hesperidin | MESH:D006569 |
789 | 261-271 | Chemical | denotes | remdesivir | MESH:C000606551 |
790 | 336-346 | Chemical | denotes | polyphenol | MESH:D059808 |
791 | 401-405 | Chemical | denotes | EGCG | MESH:C045651 |
792 | 489-493 | Chemical | denotes | EGCG | MESH:C045651 |
793 | 503-513 | Chemical | denotes | remdesivir | MESH:C000606551 |
794 | 701-705 | Chemical | denotes | EGCG | MESH:C045651 |
795 | 829-833 | Chemical | denotes | EGCG | MESH:C045651 |
LitCovid-PD-GlycoEpitope
Id | Subject | Object | Predicate | Lexical cue | glyco_epitope_db_id |
---|---|---|---|---|---|
T15 | 209-212 | GlycoEpitope | denotes | TF1 | http://www.glycoepitope.jp/epitopes/AN0049 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T302 | 0-316 | Sentence | denotes | The estimated binding free energy (ΔGbind) of remdesivir, EGCG, TF3, TF2b, and TF2a were −24.57, −27.02, −42.27, −26.74 and −27.17 kcal/mol, respectively (Table 4) and myricetin, quercetagetin, hesperidin and TF1 show lower binding affinity compared to that of remdesivir (Table S2 in the Supplementary Information). |
T303 | 317-406 | Sentence | denotes | This suggests that polyphenol TF3 binds most strongly to RdRp, followed by TF2a and EGCG. |
T304 | 407-514 | Sentence | denotes | The potency of the five inhibitors decreases in the following order: TF3 > TF2a > EGCG > TF2b > remdesivir. |
T305 | 515-644 | Sentence | denotes | TF3 binds most strongly to RdRp because both ΔEvdW and ΔEelec are more favorable to the binding compared to the other inhibitors. |
T306 | 645-905 | Sentence | denotes | Similarly, TF2a binds more strongly to RdRp compared to EGCG or TF2b because ΔGpol + elec is favorable for TF2a (ΔGpol + elec = −0.34 kcal/mol) while it is found to be unfavorable for EGCG (ΔGpol + elec = 2.24 kcal/mol) and TF2b (ΔGpol + elec = 7.83 kcal/mol). |