| Predicate |
Object |
| assignee |
http://rdf.ncbi.nlm.nih.gov/pubchem/patentassignee/MD5_0454e065bf6215137066f2f9c84b1952 |
| classificationCPCAdditional |
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16C20-70
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N5-01
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N3-084
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N7-01
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N3-126
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N3-006 |
| classificationCPCInventive |
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16C20-50
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G16B15-30
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N20-00
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N3-044
http://rdf.ncbi.nlm.nih.gov/pubchem/patentcpc/G06N3-045 |
| classificationIPCInventive |
http://rdf.ncbi.nlm.nih.gov/pubchem/patentipc/C04B30-02 |
| filingDate |
2020-03-16-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| inventor |
http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_c81e60007258ec455aaa5059a19b0530
http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_64eadba800c882aed37d1e11e633104f
http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_a185e8b41a512d374f95ccf3639e5cfb
http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_3ca64a6fe19d0ce9917cce9394fb3d9c
http://rdf.ncbi.nlm.nih.gov/pubchem/patentinventor/MD5_cfc2a9160f6c97d3c471562a1129100f |
| publicationDate |
2020-09-24-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| publicationNumber |
WO-2020190887-A1 |
| titleOfInvention |
Methods and systems for de novo molecular configurations |
| abstract |
The present disclosure provides methods and systems for identifying a small molecule configured to modulate a macromolecule described herein. The methods and systems generally use generative modeling artificial intelligence (AI) procedures to identify the small molecule based on its energy of interaction with an interaction site of the macromolecule. |
| isCitedBy |
http://rdf.ncbi.nlm.nih.gov/pubchem/patent/WO-2023171886-A1 |
| priorityDate |
2019-03-18-04:00^^<http://www.w3.org/2001/XMLSchema#date> |
| type |
http://data.epo.org/linked-data/def/patent/Publication |