Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | SLC18A3 | Q16572 | 5/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 1/20 | 0.35 |
| ▸ | QDPR | P09417 | 1/20 | 0.35 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27708991 | 0.90 | ALDH1A1 (0.43) | ALDH1A1ESR1HSD17B10SLC18A3RAB9A | |
| SCHEMBL27689299 | 0.90 | ALDH1A1 (0.43) | ALDH1A1ESR1HSD17B10SLC18A3RAB9A | |
| SCHEMBL4558845 | 0.85 | ESR2 (0.55) | ESR1CYP2C9ESR2CYP3A4 | |
| SCHEMBL5246202 | 0.85 | ESR2 (0.55) | ESR1CYP2C9ESR2CYP3A4 | |
| SCHEMBL28002067 | 0.83 | HSD17B1 (0.45) | SLC18A3CYP2C9LMNAMAPTCYP1A2 | |
| SCHEMBL9474242 | 0.83 | SLC18A3 (0.40) | SLC18A3CYP2C9ESR2NPC1RAB9A | |
| SCHEMBL9474246 | 0.83 | SLC18A3 (0.40) | SLC18A3CYP2C9ESR2NPC1RAB9A | |
| SCHEMBL27598297 | 0.83 | CYP2C9 (0.41) | ALDH1A1ESR1HSD17B10SLC18A3CYP2C9 | |
| SCHEMBL8384792 | 0.83 | SLC18A3 (0.55) | ALDH1A1SLC18A3NPC1RAB9ANPY5R | |
| SCHEMBL27711893 | 0.83 | CYP2C9 (0.41) | ALDH1A1SLC18A3CYP2C9ESR2LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1833806-A1 | OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS | AstraZeneca AB (SE) | 2007-09-19 | — | — | EP | disclosed |
| WO-2006064189-A1 | OXADIAZOLE DERIVATIVES AS DGAT INHIBITORS | ASTRAZENECA AB (SE) | 2006-06-22 | — | — | WO | disclosed |