Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 6/20 | 0.48 |
| ▸ | LIPE | Q05469 | 6/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | EBP | Q15125 | 1/20 | 0.41 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.40 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12342523 | 0.84 | HRH3 (0.45) | HRH3LIPEEBPITGB3ITGA2B | |
| SCHEMBL14752026 | 0.83 | POLB (0.51) | HRH3LIPEDRD2DRD3ITGB3 | |
| SCHEMBL12654450 | 0.83 | HRH3 (0.40) | HRH3LIPEEBPEGLN1 | |
| SCHEMBL20103215 | 0.83 | EGLN1 (0.48) | HRH3LIPEITGB3ITGA2BEGLN1 | |
| SCHEMBL18208417 | 0.83 | HRH3 (0.52) | HRH3LIPEEBP | |
| SCHEMBL18208920 | 0.83 | EBP (0.44) | HRH3LIPEEBPITGB3ITGA2B | |
| Hydrochloric Acid SCHEMBL2336913 | 0.83 | HRH3 (0.44) | HRH3LIPEEBPITGB3ITGA2B | |
| SCHEMBL12654133 | 0.81 | DOCK5 (0.56) | HRH3DRD2DRD3ALDH1A1 | |
| SCHEMBL4072091 | 0.81 | ITGB3 (0.51) | LIPEITGB3ITGA2B | |
| SCHEMBL15416950 | 0.80 | LIPE (0.43) | HRH3LIPEEBP |
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-2018078005-A1 | AMIDO-SUBSTITUTED AZASPIRO DERIVATIVES AS TANKYRASE INHIBITORS | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2018-05-03 | — | — | WO | disclosed |