Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR4 | P46093 | 10/20 | 0.55 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.55 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.55 |
| ▸ | TRPC5 | Q9UL62 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 8/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 8/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.37 |
| ▸ | EP300 | Q09472 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16965545 | 0.91 | GPR4 (0.58) | GPR4KCNH2HRH3 | |
| SCHEMBL16964963 | 0.88 | GPR4 (0.59) | GPR4KCNH2HRH3 | |
| SCHEMBL16965643 | 0.86 | GPR4 (0.73) | GPR4KCNH2HRH3 | |
| SCHEMBL16964742 | 0.86 | GPR4 (0.55) | GPR4KCNH2HRH3 | |
| SCHEMBL13578526 | 0.85 | GPR4 (0.76) | GPR4KCNH2HRH3 | |
| SCHEMBL16968375 | 0.85 | GPR4 (0.76) | GPR4KCNH2HRH3 | |
| Hydrochloric Acid SCHEMBL4326596 | 0.84 | GPR4 (0.75) | GPR4KCNH2HRH3 | |
| Hydrochloric Acid SCHEMBL4326590 | 0.84 | GPR4 (0.75) | GPR4KCNH2HRH3 | |
| SCHEMBL16964531 | 0.83 | GPR4 (0.61) | GPR4KCNH2HRH3 | |
| SCHEMBL16964709 | 0.82 | GPR4 (0.50) | GPR4KCNH2HRH3 |
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-2900237-A1 | COMPOUNDS FOR USE IN GASTRIC COMPLICATION | Novartis AG (CH) | 2015-08-05 | — | — | EP | disclosed |