Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.73 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.65 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.61 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.61 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | ATM | Q13315 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Safrolglycol SCHEMBL11447270 | 0.85 | CYP3A4 (1.00) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| Safrolglycol SCHEMBL7510518 | 0.85 | CYP3A4 (1.00) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| Safrolglycol SCHEMBL29368350 | 0.85 | CYP3A4 (1.00) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL25183681 | 0.83 | CYP3A4 (0.73) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL19354484 | 0.83 | CYP3A4 (0.73) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL25190612 | 0.83 | CYP3A4 (0.73) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL8515123 | 0.83 | SLC6A4 (0.74) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL23016555 | 0.82 | CYP3A4 (0.72) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL28067489 | 0.82 | CYP3A4 (0.71) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 | |
| SCHEMBL8416219 | 0.81 | SLC6A4 (0.83) | CYP3A4SLC6A4TAAR1SLC6A2SLC6A3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105792670-B | Organic compounds | 奇华顿股份有限公司 | 2021-02-05 | — | — | CN | disclosed |
| EP-0825189-B1 | 1,4-BENZODIOXIN DERIVATIVES | NISSHIN PHARMA INC (JP) | 2002-01-02 | — | — | EP | disclosed |
| US-6130243-A | PROPHYLACTIC OR THERAPEUTIC AGENT FOR DIABETES, HYPERGLYCEMIA AND OBESITY IN MAMMALS | NISSHIN FLOUR MILLING CO., LTD. (JP) | 2000-10-10 | — | — | US | disclosed |
| EP-0825189-A1 | 1,4-BENZODIOXIN DERIVATIVES | NISSHIN FLOUR MILLING CO., LTD. (JP) | 1998-02-25 | — | — | EP | disclosed |