Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH2 | P25021 | 5/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | ATP4A | P20648 | 4/20 | 0.32 |
| ▸ | ATP4B | P51164 | 4/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | APEX1 | P27695 | 1/20 | 0.32 |
| ▸ | PDE4A | P27815 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9639215 | 0.89 | HRH2 (0.47) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9639184 | 0.88 | CYP3A4 (0.41) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9639167 | 0.87 | HRH2 (0.67) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9640170 | 0.83 | CYP3A4 (0.48) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9640080 | 0.82 | CYP3A4 (0.44) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| Tiotidine SCHEMBL9334786 | 0.81 | CYP3A4 (0.69) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| Tiotidine SCHEMBL9334796 | 0.81 | CYP3A4 (0.69) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| Tiotidine SCHEMBL29395931 | 0.81 | CYP3A4 (0.69) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9639227 | 0.79 | HRH2 (0.40) | HRH2CYP3A4CYP2D6MAPTBCHE | |
| SCHEMBL9640511 | 0.79 | MAPT (0.44) | HRH2CYP3A4CYP2D6MAPTBCHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5120746-A | Inhibit gastric acid secretion | TOYAMA CHEMICAL CO., LTD. (JP) | 1992-06-09 | — | — | US | disclosed |
| US-4923882-A | Novel amine derivatives, salts thereof and an anti-ulcer agent containing the same | TOYAMA CHEMICAL CO., LTD. (JP) | 1990-05-08 | — | — | US | disclosed |
| US-4643849-A | ANTIULCER, ANTISECRETORY AGENTS | TOYAMA CHEMICAL CO., LTD. (JP) | 1987-02-17 | — | — | US | disclosed |