Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.46 |
| ▸ | CA1 | P00915 | 4/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | XBP1 | P17861 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 5/20 | 0.35 |
| ▸ | CES1 | P23141 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | PLA2G4C | Q9UP65 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28432823 | 1.00 | CA2 (0.46) | CA2CA1MAPK1GAAXBP1 | |
| SCHEMBL28804219 | 0.90 | CA2 (0.42) | CA2CA1MAPK1GAAXBP1 | |
| SCHEMBL6832949 | 0.90 | TAS1R3 (0.36) | CA2CA1GAANPSR1CTSK | |
| SCHEMBL6832950 | 0.90 | TAS1R3 (0.36) | CA2CA1GAANPSR1CTSK | |
| SCHEMBL28454383 | 0.86 | CA1 (0.41) | CA2CA1L3MBTL1FAAHCES1 | |
| SCHEMBL29190466 | 0.84 | CTSK (0.35) | CTSKFAAH | |
| SCHEMBL28478333 | 0.83 | CA2 (0.39) | CA2CA1MAPK1GAAXBP1 | |
| SCHEMBL525646 | 0.83 | CA2 (0.66) | CA2CA1MAPK1GAAXBP1 | |
| Potassium SCHEMBL30493921 | 0.83 | CA2 (0.66) | CA2CA1MAPK1GAAXBP1 | |
| SCHEMBL16810209 | 0.83 | CA2 (0.66) | CA2CA1MAPK1GAAXBP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113874019-A | Combinations comprising benzodioxoles as GLP-1R agonists for the treatment of NASH/NAFLD and related diseases | 辉瑞大药厂 | 2021-12-31 | — | — | CN | disclosed |