Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPD1 | P10809 | 3/20 | 0.38 |
| ▸ | HSPE1 | P61604 | 3/20 | 0.38 |
| ▸ | GRK5 | P34947 | 1/20 | 0.35 |
| ▸ | PTPN2 | P17706 | 3/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 3/20 | 0.34 |
| ▸ | MET | P08581 | 2/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 3/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.33 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.33 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28707207 | 0.85 | PIM1 (0.44) | GRK5METHDAC6PIK3CBPIK3CA | |
| SCHEMBL28710692 | 0.84 | S1PR1 (0.41) | GRK5METHDAC6HDAC3HDAC1 | |
| SCHEMBL29479735 | 0.84 | S1PR1 (0.41) | GRK5METHDAC6HDAC3HDAC1 | |
| SCHEMBL28714673 | 0.83 | GRK5 (0.49) | GRK5METPIK3CBPIK3CA | |
| SCHEMBL28701717 | 0.82 | PIK3CD (0.40) | PTPN5METHDAC6PIK3CBPIK3CA | |
| SCHEMBL28935935 | 0.82 | PIK3CD (0.40) | HDAC6PIK3CAHSD17B10NPC1RAB9A | |
| SCHEMBL31165937 | 0.82 | GRK5 (0.44) | GRK5MET | |
| SCHEMBL28701735 | 0.79 | MET (0.45) | GRK5MET | |
| SCHEMBL31165958 | 0.77 | ESR1 (0.37) | HSPD1HSPE1HDAC6ESR1ESR2 | |
| SCHEMBL28935970 | 0.77 | ESR1 (0.37) | HSPD1HSPE1HDAC6ESR1ESR2 |
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-114269725-B | Anti-influenza virus compound, preparation method and application thereof | 西藏海思科制药有限公司 | 2024-09-17 | — | — | CN | disclosed |
| CN-114269725-A | Anti-influenza virus compound and preparation method and application thereof | 四川海思科制药有限公司 | 2022-04-01 | — | — | CN | disclosed |