Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.38 |
| ▸ | F7 | P08709 | 3/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.38 |
| ▸ | F3 | P13726 | 3/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | PPARD | Q03181 | 2/20 | 0.38 |
| ▸ | PPARA | Q07869 | 2/20 | 0.38 |
| ▸ | OXER1 | Q8TDS5 | 2/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28006642 | 0.81 | GPR52 (0.51) | ALDH1A1KDM4EEPHX2 | |
| SCHEMBL28006982 | 0.79 | GPR52 (0.40) | KMT2ATDP1L3MBTL1MAPTMEN1 | |
| Pentane SCHEMBL27676126 | 0.77 | RARB (0.48) | PTPN11TSHRRARB | |
| Alcohol SCHEMBL27614988 | 0.76 | TSHR (0.47) | ALDH1A1KMT2ATDP1L3MBTL1ALOX15 | |
| Butane SCHEMBL27422579 | 0.76 | TSHR (0.47) | ALDH1A1KMT2APTPN11TDP1L3MBTL1 | |
| SCHEMBL69633 | 0.76 | TSHR (0.53) | ALDH1A1KMT2ARXRAPTGS2TDP1 | |
| Heptane SCHEMBL27762248 | 0.75 | TP53 (0.54) | PTPN11TSHRRARB | |
| Undecane SCHEMBL28025313 | 0.75 | TP53 (0.54) | PTPN11TSHRRARB | |
| SCHEMBL11664352 | 0.74 | TSHR (0.52) | ALDH1A1KMT2APTGS2TDP1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL16610510 | 0.74 | TSHR (0.52) | ALDH1A1KMT2ARXRAPTGS2TDP1 |
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-101717346-A | Artificial synthesis method of capsaicin homologue | PENG BIXIAN | 2010-06-02 | — | — | CN | claimed |
| CN-101717346-A | Artificial synthesis method of capsaicin homologue | PENG BIXIAN | 2010-06-02 | — | — | CN | disclosed |