Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.33 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | SLC18A2 | Q05940 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL23729685 | 0.83 | HTR3A (0.36) | HTR3AADORA2BADRA1BMAPK14ADORA3 | |
| SCHEMBL23729339 | 0.78 | CNR2 (0.38) | — | |
| SCHEMBL23729851 | 0.71 | HPD (0.36) | ADORA2B | |
| SCHEMBL23730201 | 0.69 | ADORA2B (0.44) | HTR3AADORA2BADORA3ADORA1KMT2A | |
| SCHEMBL23729330 | 0.64 | CNR2 (0.39) | — | |
| SCHEMBL23729701 | 0.63 | HPD (0.39) | ADORA2BSMN1; SMN2 | |
| SCHEMBL23729336 | 0.63 | CNR2 (0.36) | ADORA2BADORA1 | |
| SCHEMBL23730135 | 0.63 | HPD (0.40) | ADORA2BALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL23730109 | 0.61 | HPD (0.34) | ADORA2B | |
| SCHEMBL6395227 | 0.59 | ADORA2B (0.44) | ADORA2BADRA1BADORA3ADORA1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3858818-A1 | TRIKETONE COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF, AND HERBICIDE | Shandong Cynda Chemical Co., LTD. (CN) | 2021-08-04 | — | — | EP | disclosed |