Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD4 | P21917 | 14/20 | 0.47 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 5/20 | 0.41 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 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 | |
|---|---|---|---|---|
| SCHEMBL9228792 | 0.80 | SLC6A2 (0.50) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL5248060 | 0.80 | DRD4 (0.47) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL19867147 | 0.80 | DRD4 (0.43) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL19867149 | 0.80 | DRD4 (0.43) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL13551809 | 0.80 | DRD4 (0.43) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL13319146 | 0.79 | DRD4 (0.73) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL10981595 | 0.79 | SLC6A2 (0.49) | DRD4GRM2CYP2D6CYP1A2CYP3A4 | |
| SCHEMBL8291789 | 0.79 | DRD4 (0.73) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL5748888 | 0.79 | DRD4 (0.73) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL13554191 | 0.78 | DRD4 (0.55) | DRD4CYP2D6CYP1A2CYP3A4CYP2C9 |
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-3743430-B1 | AMINOPYRROLOTRIAZINES AS KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2023-08-02 | — | — | EP | disclosed |