Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 6/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | CCR5 | P51681 | 1/20 | 0.42 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.40 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | NOS3 | P29474 | 1/20 | 0.39 |
| ▸ | NOS2 | P35228 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.38 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.38 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18793698 | 1.00 | TRPA1 (0.50) | TRPA1LMNACCR5HKDC1AOC3 | |
| SCHEMBL1144424 | 1.00 | TRPA1 (0.50) | TRPA1LMNACCR5HKDC1AOC3 | |
| SCHEMBL1144368 | 0.88 | LMNA (0.47) | TRPA1LMNACCR5HKDC1AOC3 | |
| SCHEMBL1308070 | 0.86 | TRPA1 (0.52) | TRPA1LMNAGABBR2GABBR1RIPK1 | |
| SCHEMBL16057545 | 0.86 | LMNA (0.45) | TRPA1LMNACCR5HKDC1 | |
| SCHEMBL1144478 | 0.85 | TRPA1 (0.48) | TRPA1LMNAAOC3ESR1ESR2 | |
| Hydrogen Peroxide SCHEMBL11212534 | 0.84 | LMNA (0.52) | TRPA1LMNACCR5HKDC1AOC3 | |
| SCHEMBL17264999 | 0.83 | TRPA1 (0.56) | TRPA1LMNAHKDC1AOC3NOS3 | |
| SCHEMBL233438 | 0.82 | LMNA (0.48) | LMNACCR5HKDC1AOC3ESR1 | |
| SCHEMBL502934 | 0.82 | LMNA (0.54) | TRPA1LMNACCR5HKDC1AOC3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101020665-A | Gamma-aryl substituted chiral triazole bactericides and their synthesis process | UNIV CENTRAL CHINA NORMAL (CN) | 2007-08-22 | — | — | CN | disclosed |