Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 4/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | HTR2B | P41595 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29066468 | 0.81 | TRPA1 (0.44) | TRPA1MEN1KMT2ATSHRSLC6A2 | |
| SCHEMBL16702478 | 0.80 | OPRK1 (0.47) | MEN1KMT2AOPRK1TSHRLMNA | |
| SCHEMBL16702632 | 0.80 | OPRK1 (0.47) | MEN1KMT2AOPRK1TSHRLMNA | |
| SCHEMBL30637704 | 0.80 | OPRK1 (0.47) | MEN1KMT2AOPRK1TSHRLMNA | |
| SCHEMBL29216850 | 0.80 | OPRK1 (0.47) | TRPA1MEN1KMT2AOPRK1TSHR | |
| SCHEMBL110013 | 0.79 | TRPA1 (0.56) | TRPA1LMNASLC6A2SLC6A3CYP2D6 | |
| Hydrochloric Acid SCHEMBL9848365 | 0.79 | TRPA1 (0.50) | TRPA1TRPV1DPP4 | |
| SCHEMBL27183224 | 0.79 | ALDH1A1 (0.46) | MEN1KMT2AOPRK1TSHRLMNA | |
| SCHEMBL448011 | 0.78 | TRPA1 (0.56) | TRPA1TRPV1CYP1A2DPP4 | |
| SCHEMBL3082123 | 0.78 | SIGMAR1 (0.52) | MEN1KMT2ATSHRSLC6A2SLC6A3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | claimed |
| CN-115427421-A | 3' -ketoside compounds with slow release of volatile alcohols | 格莱克科学有限公司 | 2022-12-02 | — | — | CN | disclosed |