Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NT5E | P21589 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | CDC7 | O00311 | 2/20 | 0.32 |
| ▸ | CDK2 | P24941 | 2/20 | 0.32 |
| ▸ | PELI1 | Q96FA3 | 1/20 | 0.32 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.31 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL30108001 | 0.82 | KDM4E (0.33) | KDM4ENPC1L3MBTL1CDC7CDK2 | |
| SCHEMBL30107959 | 0.80 | KDM4E (0.44) | ADORA2AKDM4EADORA3ADORA2BHSD17B10 | |
| SCHEMBL30107988 | 0.73 | TSHR (0.33) | ADORA2AKDM4ENPC1L3MBTL1CDC7 | |
| SCHEMBL30108015 | 0.71 | HRH3 (0.46) | KDM4ENPC1L3MBTL1CDK2HRH4 | |
| SCHEMBL30107978 | 0.71 | KDM4E (0.44) | NT5EADORA2AKDM4EADORA3ADORA2B | |
| SCHEMBL30107992 | 0.71 | ADORA2A (0.37) | ADORA2AKDM4ENPC1L3MBTL1ADORA3 | |
| SCHEMBL30107957 | 0.70 | HRH4 (0.32) | KDM4ENPC1L3MBTL1HRH4HRH3 | |
| SCHEMBL30108056 | 0.70 | ADORA2A (0.47) | ADORA2AADORA2B | |
| SCHEMBL30108014 | 0.67 | KDM4E (0.42) | ADORA2AKDM4EADORA3ADORA2BHSD17B10 | |
| SCHEMBL30108012 | 0.65 | TSHR (0.58) | ADORA2AKDM4ENPC1L3MBTL1ADORA3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2022203399-A1 | ADENOSINE A2A RECEPTOR ANTAGONIST AND USE THEREOF | 주식회사 스탠다임 | 2022-09-29 | — | — | WO | disclosed |