Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 3/20 | 0.41 |
| ▸ | HRH1 | P35367 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.40 |
| ▸ | GSR | P00390 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 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 | |
|---|---|---|---|---|
| SCHEMBL13754798 | 0.78 | HTR2A (0.44) | HTR2AHRH1LMNATAAR1TDP1 | |
| SCHEMBL193835 | 0.75 | HTR2A (0.52) | TRPA1KDM4EHTR2AHRH1LMNA | |
| SCHEMBL940832 | 0.74 | LMNA (0.52) | TRPA1HTR2AHRH1LMNATAAR1 | |
| SCHEMBL148756 | 0.72 | TRPA1 (0.48) | TRPA1KDM4EHTR2ALMNATAAR1 | |
| SCHEMBL11744344 | 0.72 | SLC6A2 (0.50) | TRPA1KDM4EHTR2ALMNATAAR1 | |
| Hydrochloric Acid SCHEMBL6251948 | 0.72 | HTR2A (0.50) | TRPA1KDM4EHTR2AHRH1LMNA | |
| Ammonia Solution, Strong SCHEMBL28352255 | 0.72 | HTR2A (0.50) | TRPA1KDM4EHTR2AHRH1LMNA | |
| SCHEMBL995480 | 0.72 | SLC6A2 (0.48) | TRPA1KDM4EALDH1A1LMNATAAR1 | |
| Bromide SCHEMBL27815898 | 0.72 | HTR2A (0.39) | HTR2AHRH1LMNATAAR1TDP1 | |
| SCHEMBL197336 | 0.72 | SLC6A2 (0.48) | HTR2ATAAR1CYP2D6 |
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-1686972-A | Cross couple method for synthesizing compound of liquid crystal from 2-2 phenyl phosphine ethanol through palladium catalysis | UNIV DALIAN TECH (CN) | 2005-10-26 | — | — | CN | disclosed |