Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 2/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL11477036 | 0.80 | TRPA1 (0.35) | TRPA1ALDH1A1FAAHTSHRTDP1 | |
| SCHEMBL841626 | 0.76 | — | — | |
| SCHEMBL11474674 | 0.75 | TDP1 (0.30) | TDP1 | |
| SCHEMBL11459463 | 0.75 | FAAH (0.31) | FAAHTSHRTDP1 | |
| SCHEMBL11724430 | 0.74 | — | — | |
| SCHEMBL17129998 | 0.74 | TDP1 (0.47) | ALDH1A1TSHRTDP1 | |
| SCHEMBL17933420 | 0.70 | ALDH1A1 (0.42) | TRPA1ALDH1A1TSHRTDP1 | |
| SCHEMBL27647738 | 0.70 | TSHR (0.41) | ALDH1A1TSHRTDP1 | |
| SCHEMBL1419066 | 0.70 | HMGCR (0.52) | ALDH1A1TSHRTDP1 | |
| SCHEMBL13623133 | 0.70 | TRPA1 (0.41) | TRPA1TSHR |
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-4240983-A | HALOGENATION | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-23 | — | — | US | disclosed |