Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.45 |
| ▸ | NPC1 | O15118 | 10/20 | 0.43 |
| ▸ | RAB9A | P51151 | 10/20 | 0.43 |
| ▸ | TP53 | P04637 | 8/20 | 0.43 |
| ▸ | MAPT | P10636 | 8/20 | 0.43 |
| ▸ | PKM | P14618 | 7/20 | 0.43 |
| ▸ | TSHR | P16473 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 8/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KLF5 | Q13887 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | MITF | O75030 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28653851 | 0.87 | S1PR1 (0.55) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28659798 | 0.86 | GRM5 (0.46) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28665260 | 0.85 | NPC1 (0.51) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28661994 | 0.85 | GRM5 (0.45) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28654922 | 0.82 | NPC1 (0.54) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28664806 | 0.81 | GRM5 (0.52) | GRM5NPC1RAB9ATP53MAPT | |
| SCHEMBL28656184 | 0.78 | S1PR1 (0.48) | NPC1RAB9ATP53MAPTS1PR1 | |
| SCHEMBL20968286 | 0.72 | SMN1; SMN2 (0.52) | NPC1RAB9ATP53MAPTPKM | |
| SCHEMBL8000260 | 0.66 | SNCA (0.55) | NPC1RAB9ATP53MAPTTSHR | |
| SCHEMBL26693406 | 0.66 | USP7 (0.41) | NPC1RAB9AS1PR1KDM4EL3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113603684-B | 1,2, 4-oxadiazole Nrf2 activator-tac Lin Pinge product and preparation method and application thereof | 中国药科大学 | 2023-12-19 | — | — | CN | disclosed |
| CN-113603684-A | 1,2, 4-oxadiazole Nrf2 activator-tacrine split product and preparation method and application thereof | 中国药科大学 | 2021-11-05 | — | — | CN | disclosed |