PMC:7441777 / 19769-20634
Annnotations
LitCovid-PD-FMA-UBERON
Id | Subject | Object | Predicate | Lexical cue | fma_id |
---|---|---|---|---|---|
T34 | 159-169 | Body_part | denotes | amino acid | http://purl.org/sig/ont/fma/fma82739 |
LitCovid-PD-MONDO
Id | Subject | Object | Predicate | Lexical cue | mondo_id |
---|---|---|---|---|---|
T55 | 104-112 | Disease | denotes | SARS-CoV | http://purl.obolibrary.org/obo/MONDO_0005091 |
T56 | 305-313 | Disease | denotes | SARS-CoV | http://purl.obolibrary.org/obo/MONDO_0005091 |
T57 | 454-462 | Disease | denotes | SARS-CoV | http://purl.obolibrary.org/obo/MONDO_0005091 |
LitCovid-PD-CLO
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T115 | 507-510 | http://purl.obolibrary.org/obo/CLO_0009325 | denotes | TF1 |
T116 | 828-830 | http://purl.obolibrary.org/obo/CLO_0050050 | denotes | S1 |
LitCovid-PD-CHEBI
Id | Subject | Object | Predicate | Lexical cue | chebi_id |
---|---|---|---|---|---|
T277 | 71-82 | Chemical | denotes | polyphenols | http://purl.obolibrary.org/obo/CHEBI_26195 |
T278 | 152-158 | Chemical | denotes | ligand | http://purl.obolibrary.org/obo/CHEBI_52214 |
T279 | 159-169 | Chemical | denotes | amino acid | http://purl.obolibrary.org/obo/CHEBI_33709 |
T280 | 159-164 | Chemical | denotes | amino | http://purl.obolibrary.org/obo/CHEBI_46882 |
T281 | 165-169 | Chemical | denotes | acid | http://purl.obolibrary.org/obo/CHEBI_37527 |
T282 | 203-206 | Chemical | denotes | GTP | http://purl.obolibrary.org/obo/CHEBI_15996|http://purl.obolibrary.org/obo/CHEBI_37565 |
T284 | 211-221 | Chemical | denotes | remdesivir | http://purl.obolibrary.org/obo/CHEBI_145994 |
T285 | 328-339 | Chemical | denotes | polyphenols | http://purl.obolibrary.org/obo/CHEBI_26195 |
T286 | 423-434 | Chemical | denotes | polyphenols | http://purl.obolibrary.org/obo/CHEBI_26195 |
T287 | 496-499 | Chemical | denotes | TF3 | http://purl.obolibrary.org/obo/CHEBI_136608 |
T288 | 518-528 | Chemical | denotes | hesperidin | http://purl.obolibrary.org/obo/CHEBI_28775 |
T289 | 530-534 | Chemical | denotes | EGCG | http://purl.obolibrary.org/obo/CHEBI_4806 |
T290 | 536-545 | Chemical | denotes | myricetin | http://purl.obolibrary.org/obo/CHEBI_18152|http://purl.obolibrary.org/obo/CHEBI_58395 |
T292 | 550-563 | Chemical | denotes | quercetagetin | http://purl.obolibrary.org/obo/CHEBI_8695 |
T293 | 740-751 | Chemical | denotes | polyphenols | http://purl.obolibrary.org/obo/CHEBI_26195 |
LitCovid-PubTator
Id | Subject | Object | Predicate | Lexical cue | tao:has_database_id |
---|---|---|---|---|---|
446 | 92-96 | Gene | denotes | RdRp | Gene:43740578 |
447 | 316-320 | Gene | denotes | RdRp | Gene:43740578 |
448 | 465-469 | Gene | denotes | RdRp | Gene:43740578 |
449 | 501-505 | Gene | denotes | TF2b | Gene:2959 |
450 | 705-709 | Gene | denotes | RdRp | Gene:43740578 |
451 | 104-114 | Species | denotes | SARS-CoV-2 | Tax:2697049 |
452 | 305-315 | Species | denotes | SARS-CoV-2 | Tax:2697049 |
453 | 454-464 | Species | denotes | SARS-CoV-2 | Tax:2697049 |
454 | 0-11 | Chemical | denotes | Polyphenols | MESH:D059808 |
455 | 71-82 | Chemical | denotes | polyphenols | MESH:D059808 |
456 | 203-206 | Chemical | denotes | GTP | MESH:D006160 |
457 | 211-221 | Chemical | denotes | remdesivir | MESH:C000606551 |
458 | 328-339 | Chemical | denotes | polyphenols | MESH:D059808 |
459 | 423-434 | Chemical | denotes | polyphenols | MESH:D059808 |
460 | 518-528 | Chemical | denotes | hesperidin | MESH:D006569 |
461 | 530-534 | Chemical | denotes | EGCG | MESH:C045651 |
462 | 536-545 | Chemical | denotes | myricetin | MESH:C040015 |
463 | 550-563 | Chemical | denotes | quercetagetin | MESH:C079163 |
464 | 564-566 | Chemical | denotes | as | MESH:D001151 |
465 | 740-751 | Chemical | denotes | polyphenols | MESH:D059808 |
LitCovid-PD-GlycoEpitope
Id | Subject | Object | Predicate | Lexical cue | glyco_epitope_db_id |
---|---|---|---|---|---|
T5 | 507-510 | GlycoEpitope | denotes | TF1 | http://www.glycoepitope.jp/epitopes/AN0049 |
LitCovid-sentences
Id | Subject | Object | Predicate | Lexical cue |
---|---|---|---|---|
T201 | 0-183 | Sentence | denotes | Polyphenols exhibiting binding energy of −7.0 kcal/mol or lower (eight polyphenols) against RdRp of the SARS-CoV-2 are listed in Table 2 along with the ligand-amino acid interactions. |
T202 | 184-321 | Sentence | denotes | Control compounds, GTP and remdesivir, exhibited the binding energy of −7.9 and −7.7 kcal/mol, respectively, against the SARS-CoV-2 RdRp. |
T203 | 322-665 | Sentence | denotes | Eight polyphenols displayed significantly higher binding affinity among the selected hundred natural polyphenols docked against the SARS-CoV-2 RdRp, with binding energies of TF3, TF2b, TF1, TF2a, hesperidin, EGCG, myricetin and quercetagetin as −9.9, −9.6, −9.6, −9.3, −8.8, −7.3, −7.2 and −7.0 kcal/mol, respectively (highlighted in Table 1). |
T204 | 666-865 | Sentence | denotes | Further, 2D LigPlot+ representation of RdRp and the above-mentioned eight polyphenols reveal the stable network of molecular interactions (see Table 2 and Figure S1 in the Supplementary Information). |