Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.41 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | UGCG | Q16739 | 5/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2600416 | 1.00 | SLC6A4 (0.56) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL13460314 | 1.00 | SLC6A4 (0.56) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL21729367 | 0.99 | SLC6A4 (0.55) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL21309297 | 0.85 | SLC6A4 (0.50) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL19043185 | 0.83 | CHRM3 (0.48) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL7997916 | 0.83 | CHRM3 (0.48) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL24045408 | 0.82 | SLC6A4 (0.49) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL19043529 | 0.81 | CYP2D6 (0.45) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL19625066 | 0.80 | CYP2D6 (0.48) | SLC6A4CYP2D6TAAR1SLC6A2SLC6A3 | |
| SCHEMBL20799431 | 0.79 | SLC6A4 (0.35) | SLC6A4SLC6A3KMT2AALDH1A1UGCG |
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-3611171-A1 | METHOD FOR SYNTHESIS OF ELIGLUSTAT AND INTERMEDIATE COMPOUNDS THEREOF | Zhejiang Ausun Pharmaceutical Co., Ltd. (CN) | 2020-02-19 | — | — | EP | disclosed |