Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 3/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ACP3 | P15309 | 2/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | ADRA1B | P35368 | 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 | |
|---|---|---|---|---|
| SCHEMBL11348133 | 0.77 | ALDH1A1 (0.58) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL3246866 | 0.74 | ALDH1A1 (0.54) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL28140563 | 0.72 | CYP2C9 (0.52) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL3255966 | 0.72 | ALDH1A1 (0.62) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL5011023 | 0.71 | SLC6A4 (0.51) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL8375779 | 0.71 | CYP2C19 (0.50) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL10734251 | 0.71 | ALDH1A1 (0.50) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL7453633 | 0.71 | ALDH1A1 (0.50) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL264495 | 0.71 | ALDH1A1 (0.50) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 | |
| SCHEMBL2494544 | 0.69 | ALDH1A1 (0.65) | CYP2C9CYP2C19CYP1A2ALDH1A1SLC6A4 |
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 |