Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1649592 | 1.00 | TRPA1 (0.36) | TRPA1 | |
| SCHEMBL30984425 | 1.00 | TRPA1 (0.36) | TRPA1 | |
| SCHEMBL6789771 | 0.73 | PARP1 (0.39) | — | |
| SCHEMBL15902739 | 0.73 | PARP1 (0.39) | — | |
| SCHEMBL846505 | 0.73 | PARP1 (0.39) | — | |
| SCHEMBL29355434 | 0.73 | PARP1 (0.39) | — | |
| Hydrochloric Acid SCHEMBL9670228 | 0.71 | PARP1 (0.42) | — | |
| SCHEMBL5109909 | 0.69 | TRPA1 (0.39) | TRPA1 | |
| SCHEMBL11843522 | 0.69 | PARP1 (0.33) | — | |
| SCHEMBL135836 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7927613-B2 | Pharmaceutical co-crystal compositions | UNIVERSITY OF SOUTH FLORIDA (US) | 2011-04-19 | — | — | US | disclosed |
| US-7790905-B2 | Pharmaceutical propylene glycol solvate compositions | MCNEIL-PPC, INC. (US) | 2010-09-07 | — | — | US | disclosed |