Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 15/20 | 0.81 |
| ▸ | DRD2 | P14416 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9879618 | 0.83 | SIGMAR1 (1.00) | SIGMAR1DRD2ALDH1A1HTR1A | |
| Hydrochloric Acid SCHEMBL9874846 | 0.82 | SIGMAR1 (0.97) | SIGMAR1DRD2ALDH1A1HTR1A | |
| SCHEMBL9531074 | 0.77 | SIGMAR1 (0.74) | SIGMAR1DRD2HTR1APPARGPPARA | |
| SCHEMBL13211790 | 0.75 | DRD2 (0.81) | SIGMAR1DRD2HTR1A | |
| Hydrochloric Acid SCHEMBL9092965 | 0.75 | SIGMAR1 (0.77) | SIGMAR1DRD2HTR1A | |
| SCHEMBL13211781 | 0.73 | DRD2 (0.81) | SIGMAR1DRD2HTR1A | |
| SCHEMBL10538180 | 0.72 | DRD2 (0.73) | SIGMAR1DRD2HTR1A | |
| Hydrochloric Acid SCHEMBL8970660 | 0.72 | SIGMAR1 (0.79) | SIGMAR1DRD2HTR1A | |
| SCHEMBL11793421 | 0.72 | DRD2 (1.00) | SIGMAR1DRD2HTR1A | |
| SCHEMBL9879898 | 0.71 | SIGMAR1 (0.44) | SIGMAR1ALDH1A1HTTTAAR1 |
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-1991008200-A1 | NOVEL TETRAHYDROPYRIDINE DERIVATIVES, A PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING SUCH COMPOUNDS AS ACTIVE AGENTS | Richter Gedeon Vegyészeti Gyár Rt. (HU) | 1991-06-13 | — | — | WO | claimed |