Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.40 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9080881 | 0.77 | TRPM8 (0.60) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| SCHEMBL29449737 | 0.76 | TRPM8 (0.50) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| SCHEMBL25349880 | 0.76 | TRPM8 (0.50) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| Methane SCHEMBL22319781 | 0.74 | TRPM8 (0.48) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| SCHEMBL8147763 | 0.73 | — | — | |
| SCHEMBL3054956 | 0.72 | TRPA1 (0.37) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7097420 | 0.70 | — | — | |
| SCHEMBL1653614 | 0.69 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL9684305 | 0.69 | TRPA1 (0.40) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 | |
| SCHEMBL8548065 | 0.68 | TRPM8 (0.59) | TRPA1TRPM8KCNA5EPHX1ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0809647-B1 | CHIRAL ORGANOMETALLIC COMPOUNDS | AVECIA LTD (GB) | 2003-09-10 | — | — | EP | disclosed |
| US-5929266-A | ZIRCONIUM, HAFNIUM, TITANIUM CYCLOPENTADIENE COMPOUNDS USEFUL IN ASYMMETRIC SYNTHESIS | ZENECA LIMITED (GB) | 1999-07-27 | — | — | US | disclosed |
| EP-0809647-A1 | CHIRAL ORGANOMETALLIC COMPOUNDS | ZENECA LIMITED (GB) | 1997-12-03 | — | — | EP | disclosed |
| WO-1996025420-A1 | CHIRAL ORGANOMETALLIC COMPOUNDS | ZENECA LIMITED (GB) | 1996-08-22 | — | — | WO | disclosed |