Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 6/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | RNASEL | Q05823 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9870868 | 0.89 | TRPA1 (0.40) | TRPA1TSHRL3MBTL1TDP1MAPK1 | |
| SCHEMBL9869675 | 0.88 | TRPA1 (0.39) | TRPA1TSHRL3MBTL1TDP1MAPK1 | |
| SCHEMBL9306535 | 0.84 | MAOA (0.34) | MAPT | |
| SCHEMBL9806531 | 0.84 | MAOA (0.34) | MAPT | |
| SCHEMBL7189428 | 0.84 | MAOA (0.36) | TRPA1TSHRL3MBTL1TDP1MAPK1 | |
| SCHEMBL9849388 | 0.81 | TDP1 (0.39) | TSHRL3MBTL1TDP1MAPK1CYP3A4 | |
| SCHEMBL1347590 | 0.79 | TRPA1 (0.53) | TRPA1TSHRL3MBTL1TDP1MAPK1 | |
| SCHEMBL9849817 | 0.79 | P2RX4 (0.37) | TSHRL3MBTL1TDP1MAPK1CYP3A4 | |
| SCHEMBL1386991 | 0.78 | MAOA (0.36) | TSHRTDP1MAPK1CYP3A4ALDH1A1 | |
| SCHEMBL146940 | 0.78 | TRPA1 (0.59) | TRPA1TSHRL3MBTL1TDP1MAPK1 |
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-5026492-A | Synergistic; improved wear resistance in internal combustion engines | EXXON RESEARCH & ENGINEERING COMPANY (US) | 1991-06-25 | — | — | US | disclosed |