Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 6/20 | 0.35 |
| ▸ | S1PR3 | Q99500 | 3/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 13/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 13/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 12/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL30587801 | 1.00 | S1PR1 (0.35) | S1PR1S1PR3OPRM1OPRK1OPRD1 | |
| SCHEMBL26105733 | 0.96 | S1PR1 (0.34) | S1PR1S1PR3 | |
| SCHEMBL26109227 | 0.91 | OPRM1 (0.34) | OPRM1OPRK1OPRD1 | |
| SCHEMBL30629082 | 0.88 | OPRM1 (0.34) | OPRM1OPRK1OPRD1ALDH1A1GAA | |
| SCHEMBL26109313 | 0.87 | S1PR1 (0.30) | S1PR1 | |
| SCHEMBL26111989 | 0.87 | CYP1A2 (0.30) | — | |
| SCHEMBL26109556 | 0.85 | SLC34A2 (0.33) | S1PR1S1PR3 | |
| SCHEMBL30587797 | 0.83 | MEN1 (0.36) | ALDH1A1GAAMAPT | |
| SCHEMBL26108216 | 0.83 | MEN1 (0.36) | ALDH1A1GAAMAPT | |
| SCHEMBL26107505 | 0.81 | S1PR1 (0.33) | S1PR1S1PR3 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116836157-A | Oxadiazole derivative and preparation method and application thereof | 星希尔生物科技(上海)有限公司 | 2023-10-03 | — | — | CN | disclosed |
| WO-2023179366-A1 | OXADIAZOLE DERIVATIVE, PREPARATION METHOD THEREFOR AND USE THEREOF | 星希尔生物科技(上海)有限公司 | 2023-09-28 | — | — | WO | disclosed |