Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.33 |
| ▸ | METAP2 | P50579 | 2/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | METAP1 | P53582 | 1/20 | 0.31 |
| ▸ | NR3C1 | P04150 | 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 | |
|---|---|---|---|---|
| SCHEMBL19286232 | 1.00 | TRPA1 (0.33) | TRPA1SLC6A2SLC6A4SLC6A3METAP2 | |
| SCHEMBL19286303 | 0.82 | ACHE (0.33) | TRPA1L3MBTL1 | |
| SCHEMBL19286316 | 0.79 | NR3C1 (0.33) | TRPA1L3MBTL1NR3C1 | |
| SCHEMBL22147829 | 0.79 | TRPA1 (0.30) | TRPA1 | |
| SCHEMBL19286279 | 0.78 | L3MBTL1 (0.32) | L3MBTL1 | |
| SCHEMBL19286212 | 0.73 | NR3C1 (0.31) | NR3C1 | |
| SCHEMBL19286247 | 0.72 | ALPL (0.42) | L3MBTL1 | |
| SCHEMBL19286318 | 0.72 | ACE (0.36) | — | |
| SCHEMBL19286314 | 0.72 | ALPL (0.42) | L3MBTL1 | |
| SCHEMBL20684328 | 0.68 | KDM4E (0.41) | SLC6A2SLC6A4SLC6A3 |
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-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |