Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HPD | P32754 | 4/20 | 0.34 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.33 |
| ▸ | TNF | P01375 | 1/20 | 0.32 |
| ▸ | ADORA2B | P29275 | 5/20 | 0.31 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | FABP4 | P15090 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23729824 | 0.88 | HPD (0.37) | HPDTNFADORA2BADORA2ACNR2 | |
| SCHEMBL23729826 | 0.87 | HPD (0.38) | ALDH1A1HPDMAPT | |
| SCHEMBL23729328 | 0.86 | HPD (0.36) | ALDH1A1HPDMAPT | |
| SCHEMBL23729701 | 0.84 | HPD (0.39) | HPDTNFADORA2BADORA2ACNR2 | |
| SCHEMBL23729853 | 0.83 | HPD (0.38) | ALDH1A1LMNAHPDGAA | |
| SCHEMBL23729829 | 0.82 | HPD (0.36) | HPDTRPC5TNFADORA2BADORA2A | |
| SCHEMBL23729698 | 0.82 | HPD (0.38) | LMNAHPDTRPC5ADORA2BADORA2A | |
| SCHEMBL23729879 | 0.80 | HPD (0.38) | HPDADORA2BADORA2A | |
| SCHEMBL23729825 | 0.80 | HPD (0.40) | HPDADORA2BADORA2AADORA1 | |
| SCHEMBL23730135 | 0.75 | HPD (0.40) | ALDH1A1HPDADORA2BADORA2ACNR2 |
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 |