Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.50 |
| ▸ | IDO1 | P14902 | 3/20 | 0.43 |
| ▸ | AGXT | P21549 | 2/20 | 0.43 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.40 |
| ▸ | NOS3 | P29474 | 1/20 | 0.40 |
| ▸ | NOS1 | P29475 | 1/20 | 0.40 |
| ▸ | NOS2 | P35228 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL6205902 | 0.80 | TRPA1 (0.50) | TRPA1IDO1AGXTLOXL2MAOB | |
| SCHEMBL12862072 | 0.80 | TRPA1 (0.46) | TRPA1IDO1AGXTLOXL2MAOB | |
| SCHEMBL6205901 | 0.80 | TRPA1 (0.46) | TRPA1IDO1AGXTLOXL2MAOB | |
| SCHEMBL9484637 | 0.78 | AGXT (0.44) | IDO1AGXTMAOBTAAR1SLC6A4 | |
| SCHEMBL7522498 | 0.78 | LPL (0.44) | TAAR1SLC6A4TSHR | |
| SCHEMBL5758636 | 0.77 | TRPA1 (0.47) | TRPA1IDO1AGXTLOXL2MAOB | |
| SCHEMBL1070963 | 0.76 | SLC6A4 (0.63) | IDO1AGXTTAAR1SLC6A4TSHR | |
| SCHEMBL14240823 | 0.76 | PPARG (0.41) | TRPA1TAAR1NOS3NOS1SLC6A4 | |
| SCHEMBL12433178 | 0.76 | IDO1 (0.43) | IDO1MAOBTAAR1SLC6A4 | |
| SCHEMBL9260666 | 0.76 | TAAR1 (0.56) | IDO1TAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5130435-A | Elimination of alcohol from an acetal or ketal in the presence of phosphates | BASF AKTIENGESELLSCHAFT (DE) | 1992-07-14 | — | — | US | disclosed |