Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | CCR6 | P51684 | 1/20 | 0.49 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.43 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6560598 | 0.83 | HTT (0.54) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL31629174 | 0.83 | CCR6 (0.62) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL164180 | 0.81 | ALDH1A1 (0.51) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL7405570 | 0.81 | HTT (0.51) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| Hydrochloric Acid SCHEMBL7216444 | 0.79 | HTT (0.50) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL2195997 | 0.79 | CCR6 (0.55) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL7366351 | 0.78 | CCR6 (0.53) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL2212416 | 0.78 | CCR6 (0.57) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL23683127 | 0.77 | CCR6 (0.56) | HTTCCR6PAX8ALDH1A1L3MBTL1 | |
| SCHEMBL18285962 | 0.77 | HTT (0.45) | HTTCCR6PAX8ALDH1A1L3MBTL1 |
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-0998488-A1 | POLYOL-AMINO ACID COMPOUNDS HAVING ANTI-HELICOBACTER PYLORI ACTIVITY | Takeda Chemical Industries, Ltd. (JP) | 2000-05-10 | — | — | EP | disclosed |
| WO-1999002549-A1 | POLYOL-AMINO ACID COMPOUNDS HAVING ANTI-HELICOBACTER PYLORI ACTIVITY | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1999-01-21 | — | — | WO | disclosed |