Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | ERN1 | O75460 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.33 |
| ▸ | PDCD1LG2 | Q9BQ51 | 1/20 | 0.33 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL8709585 | 0.81 | GAA (0.48) | GAAALDH1A1NPC1MAPTNPSR1 | |
| SCHEMBL8406828 | 0.79 | GAA (0.42) | GAAALDH1A1TAAR1NPC1MAPT | |
| SCHEMBL16198301 | 0.75 | GAA (0.48) | GAAALDH1A1NPC1MAPTNPSR1 | |
| SCHEMBL4401042 | 0.75 | GAA (0.48) | GAAALDH1A1TAAR1NPC1MAPT | |
| SCHEMBL1196055 | 0.74 | KDM4E (0.47) | TAAR1KDM4ETRPV4ADRA1A | |
| SCHEMBL1306371 | 0.74 | TRPV4 (0.46) | GAATAAR1MAPTTSHRMAPK1 | |
| SCHEMBL15358120 | 0.74 | ALDH1A1 (0.37) | GAAALDH1A1TAAR1MAPTHTT | |
| SCHEMBL2084949 | 0.74 | MAP3K14 (0.44) | GAAALDH1A1NPC1MAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL31321966 | 0.73 | KDM4E (0.46) | TAAR1KDM4EADRA1A | |
| Hydrochloric Acid SCHEMBL31717168 | 0.73 | TRPV4 (0.44) | GAATAAR1MAPTTSHRMAPK1 |
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-1768050-A | Benzopyran compounds for the treatment of inflammation | PHARMACIA CORP (US) | 2006-05-03 | — | — | CN | disclosed |