Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL7963110 | 0.85 | SLC6A3 (0.57) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7963041 | 0.81 | SLC6A3 (0.56) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL7439094 | 0.77 | SLC6A3 (1.00) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9714837 | 0.77 | SLC6A3 (0.63) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL17429837 | 0.77 | SLC6A3 (0.63) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL16011833 | 0.77 | SLC6A3 (0.63) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6827648 | 0.76 | SLC6A3 (0.61) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| Hydrochloric Acid SCHEMBL7438013 | 0.76 | SLC6A3 (0.96) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL2146152 | 0.75 | CYP2C19 (0.37) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL15313231 | 0.74 | SLC6A3 (0.59) | SLC6A3SLC6A4CYP1A2CYP3A4CYP2D6 |
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-6323235-B1 | CARDIOVASCULAR DISORDERS, ANTIISCHEMIC AGENTS AND ENZYME INHIBITORS | OHTAKE ATSUSHI (JP) | 2001-11-27 | — | — | US | disclosed |
| US-6043264-A | A THROMBOXANE A2 RECEPTOR ANTAGONIST FOR TREATING HYPERTENSION, THROMBOSIS, ISCHEMIC HEART DISEASES, CIRCULATORY DISEASES, ARTERIOSCLEROSIS, PLATELET FUNCTION DISORDER, HYPERLIPIDEMIA, NEPHRITIS OR ASTHMA | TORAY INDUSTRIES, INC. (JP) | 2000-03-28 | — | — | US | disclosed |
| EP-0751126-A1 | BENZENE-FUSED HETEROCYCLIC DERIVATIVE AND USE OF THE SAME | TORAY INDUSTRIES, INC. (JP) | 1997-01-02 | — | — | EP | disclosed |