Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 6/20 | 0.41 |
| ▸ | AGXT | P21549 | 4/20 | 0.41 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.41 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 4/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2567905 | 1.00 | TRPA1 (0.42) | TRPA1ALDH1A1TSHRIDO1AGXT | |
| SCHEMBL487468 | 0.89 | IDO1 (0.48) | IDO1AGXTMAOBFFAR1ERN1 | |
| Methoxymethane SCHEMBL28161427 | 0.86 | TSHR (0.50) | TRPA1ALDH1A1TSHRIDO1AGXT | |
| SCHEMBL14508909 | 0.83 | TRPA1 (0.39) | TRPA1ALDH1A1TSHRIDO1AGXT | |
| SCHEMBL27826128 | 0.83 | TDP1 (0.46) | IDO1AGXTMAOBFFAR1ERN1 | |
| SCHEMBL3149674 | 0.81 | PTPN1 (0.46) | CYP4F2CYP4A11 | |
| SCHEMBL348159 | 0.81 | ALDH1A1 (0.61) | TRPA1ALDH1A1TSHRIDO1AGXT | |
| SCHEMBL2213709 | 0.81 | ALDH1A1 (0.61) | TRPA1ALDH1A1TSHRIDO1AGXT | |
| SCHEMBL12305 | 0.80 | TP53 (0.44) | ALDH1A1IDO1AGXTMAOBFFAR1 | |
| SCHEMBL21587350 | 0.79 | HTR7 (0.50) | ALDH1A1TSHRMAOB |
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-110869373-B | Antibiotic resistance disruptors | 伦敦皇家学院 | 2023-03-07 | — | — | CN | disclosed |