Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 5/20 | 0.37 |
| ▸ | BCHE | P06276 | 5/20 | 0.37 |
| ▸ | BACE1 | P56817 | 3/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 5/20 | 0.36 |
| ▸ | DRD4 | P21917 | 5/20 | 0.36 |
| ▸ | DRD3 | P35462 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HTR6 | P50406 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9045686 | 0.99 | ACHE (0.37) | ACHEBCHEBACE1CYP1A2CYP3A4 | |
| SCHEMBL9046919 | 0.83 | DRD2 (0.40) | ACHEBCHECYP1A2CYP2D6DRD2 | |
| SCHEMBL9045676 | 0.80 | BCHE (0.40) | ACHEBCHECYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL9049957 | 0.79 | BCHE (0.39) | ACHEBCHECYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9047273 | 0.73 | — | — | |
| Iodide SCHEMBL9047066 | 0.70 | — | — | |
| Fumaric Acid SCHEMBL9047824 | 0.69 | TSHR (0.30) | — | |
| SCHEMBL9047834 | 0.66 | CHEK1 (0.44) | ACHEBCHEBACE1DRD2DRD4 | |
| Hydrochloric Acid SCHEMBL9047300 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL9045678 | 0.65 | ACHE (0.43) | ACHEBCHEBACE1DRD2DRD4 |
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-0749966-A1 | 5-HT 3 RECEPTOR AGONIST, NOVEL THIAZOLE DERIVATIVE, AND INTERMEDIATE THEREFOR | YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) | 1996-12-27 | — | — | EP | disclosed |