Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | SCN4A | P35499 | 2/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.33 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL13669478 | 0.78 | TRPA1 (0.37) | TRPA1SLC6A4 | |
| SCHEMBL11789210 | 0.74 | — | — | |
| SCHEMBL730201 | 0.70 | — | — | |
| SCHEMBL5200403 | 0.68 | — | — | |
| SCHEMBL16916991 | 0.67 | HDAC3 (0.36) | — | |
| SCHEMBL16173930 | 0.65 | TRPA1 (0.34) | TRPA1SLC6A4 | |
| SCHEMBL13747195 | 0.64 | PMP22 (0.48) | TRPA1CYP1A2 | |
| SCHEMBL18655478 | 0.64 | TRPA1 (0.38) | TRPA1SLC6A4 | |
| SCHEMBL11144268 | 0.64 | TRPA1 (0.36) | TRPA1GABBR2GABBR1CA2 | |
| SCHEMBL368519 | 0.64 | — | — |
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-9086411-B2 | Resin assisted capture of cysteine-modified proteins/peptides and determination of presence and location of modification | DUKE UNIVERSITY (US) | 2015-07-21 | — | — | US | disclosed |