Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.58 |
| ▸ | LMNA | P02545 | 1/20 | 0.58 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.58 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.58 |
| ▸ | HTR2B | P41595 | 1/20 | 0.58 |
| ▸ | CNR1 | P21554 | 2/20 | 0.44 |
| ▸ | CNR2 | P34972 | 2/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | NPBWR1 | P48145 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| Thymol SCHEMBL28980177 | 0.87 | TRPA1 (0.60) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Thymol SCHEMBL27973976 | 0.87 | LMNA (0.78) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Stearic Acid SCHEMBL28080450 | 0.86 | TRPA1 (0.58) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Thymol SCHEMBL29143213 | 0.86 | TRPA1 (0.58) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Dodecanoate SCHEMBL17073978 | 0.86 | TRPA1 (0.58) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Thymol SCHEMBL15456835 | 0.86 | TRPA1 (0.58) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Nonanoate SCHEMBL28319012 | 0.86 | TRPA1 (0.58) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Undecane SCHEMBL6583325 | 0.85 | TRPA1 (0.75) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Thymol SCHEMBL249974 | 0.83 | TRPA1 (0.62) | TRPA1LMNACHRM1SLC6A2ADRA1A | |
| Thymol SCHEMBL249687 | 0.81 | LMNA (0.72) | TRPA1LMNACHRM1SLC6A2ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2043620-A2 | COMPOSITIONS AND METHODS FOR TREATING PARASITIC INFECTIONS | Tyratech, Inc. (US) | 2009-04-08 | — | — | EP | disclosed |
| WO-2008003007-A2 | COMPOSITIONS AND METHODS FOR TREATING PARASITIC INFECTIONS | TYRATECH, INC. (US) | 2008-01-03 | — | — | WO | disclosed |