Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.38 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.38 |
| ▸ | MMP13 | P45452 | 6/20 | 0.38 |
| ▸ | MMP1 | P03956 | 3/20 | 0.38 |
| ▸ | MMP3 | P08254 | 3/20 | 0.38 |
| ▸ | MMP7 | P09237 | 3/20 | 0.38 |
| ▸ | MMP9 | P14780 | 3/20 | 0.38 |
| ▸ | MMP8 | P22894 | 3/20 | 0.38 |
| ▸ | MMP2 | P08253 | 2/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 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 | |
|---|---|---|---|---|
| SCHEMBL4598118 | 0.91 | NR1H2 (0.41) | ESR2ALDH1A1HTTNPC1MAPT | |
| SCHEMBL951850 | 0.80 | ESR2 (0.48) | ESR2MAPK1NR1H2GPR119ADORA1 | |
| SCHEMBL25262018 | 0.80 | ESR2 (0.45) | ESR2ALDH1A1MAPTMAPK1NR1H2 | |
| SCHEMBL952114 | 0.80 | ESR2 (0.45) | ESR2MAPK1NR1H2PTPN2PTPN1 | |
| SCHEMBL4598190 | 0.78 | REN (0.35) | GPR119 | |
| SCHEMBL4597030 | 0.75 | ESR2 (0.40) | ESR2NR1H2PTPN2PTPN1PTPN6 | |
| SCHEMBL6375289 | 0.75 | GPR119 (0.56) | ALDH1A1HTTNPC1MAPTMAPK1 | |
| SCHEMBL8265146 | 0.74 | ESR2 (0.45) | ESR2ALDH1A1MAPTMAPK1NR1H2 | |
| SCHEMBL8264160 | 0.73 | USP30 (0.47) | ESR2MAPK1NR1H2PTPN2PTPN1 | |
| SCHEMBL1752020 | 0.73 | MGAT2 (0.48) | ESR2ALDH1A1NPC1MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1908471-A1 | Tetrahydropyridines as renin inhibitors | Speedel Experimenta AG (CH) | 2008-04-09 | — | — | EP | disclosed |