Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.52 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SLC16A3 | O15427 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | SLC16A1 | P53985 | 1/20 | 0.48 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL21561422 | 1.00 | PTGES (0.52) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL21572153 | 1.00 | PTGES (0.52) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL12296669 | 1.00 | PTGES (0.52) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL23572562 | 0.93 | PTGES (0.55) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL9360610 | 0.93 | PTGES (0.55) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL9360606 | 0.93 | PTGES (0.55) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL29918400 | 0.93 | PTGES (0.55) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL9361312 | 0.93 | PTGES (0.55) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL9361056 | 0.91 | CISD1 (0.54) | PTGESCISD1KDM4ESLC16A3ALDH1A1 | |
| SCHEMBL9361052 | 0.91 | CISD1 (0.54) | PTGESCISD1KDM4ESLC16A3ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-10481163-B1 | Mass spectrometry method using mixed matrix | SHIMADZU CORPORATION (JP) | 2019-11-19 | — | — | US | disclosed |