Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLP1R | P43220 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 11/20 | 0.40 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | LGALS8 | O00214 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | ACSL1 | P33121 | 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 | |
|---|---|---|---|---|
| SCHEMBL7478557 | 0.85 | NPSR1 (0.43) | NPSR1PPARGAPEX1LGALS8ALDH1A1 | |
| SCHEMBL7481362 | 0.80 | PIN1 (0.40) | GLP1RPIN1 | |
| SCHEMBL7477294 | 0.74 | APEX1 (0.44) | NPSR1APEX1ALDH1A1MAPK1 | |
| SCHEMBL9063730 | 0.73 | GRIN1 (0.51) | PIN1GRIN1GRIN2B | |
| SCHEMBL6172717 | 0.71 | PPARG (0.53) | GLP1RPPARGLGALS8 | |
| SCHEMBL4069583 | 0.71 | PIN1 (0.49) | PIN1GRIN1GRIN2BALDH1A1 | |
| SCHEMBL29281094 | 0.71 | LGALS8 (0.55) | PPARGLGALS8 | |
| Hydrochloric Acid SCHEMBL6170063 | 0.70 | PPARG (0.54) | GLP1RPPARGLGALS8 | |
| SCHEMBL7408823 | 0.70 | F10 (0.59) | — | |
| SCHEMBL7072284 | 0.70 | KMT2A (0.45) | ALDH1A1MAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2000020400-A1 | NOVEL COMPOUNDS AND COMPOSITIONS FOR TREATING HEPATITIS C INFECTIONS | AXYS PHARMACEUTICALS, INC. (US) | 2000-04-13 | — | — | WO | disclosed |