Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.36 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.33 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.32 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7379246 | 0.92 | ALDH1A1 (0.46) | PAOXALDH1A1NPSR1ALOX15SIGMAR1 | |
| SCHEMBL15782717 | 0.83 | ALDH1A1 (0.39) | PAOXALDH1A1CACNA2D1NPSR1ALOX15 | |
| SCHEMBL632011 | 0.81 | — | — | |
| Bromide SCHEMBL28368955 | 0.79 | ALDH1A1 (0.36) | PAOXALDH1A1SIGMAR1KDM4E | |
| SCHEMBL6656746 | 0.79 | PAOX (0.59) | PAOXALDH1A1CACNA2D1NPSR1ALOX15 | |
| SCHEMBL759447 | 0.79 | PAOX (0.59) | PAOXALDH1A1CACNA2D1NPSR1ALOX15 | |
| SCHEMBL15188891 | 0.78 | ALOX15 (0.33) | ALOX15 | |
| SCHEMBL234338 | 0.78 | SIGMAR1 (0.48) | PAOXALDH1A1NPSR1CHRM2SIGMAR1 | |
| SCHEMBL15052279 | 0.78 | SIGMAR1 (0.48) | PAOXALDH1A1NPSR1CHRM2SIGMAR1 | |
| SCHEMBL755265 | 0.77 | PAOX (0.62) | PAOXALDH1A1CACNA2D1CHRM2SIGMAR1 |
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-3154966-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE THEREOF | US HEALTH (US) | 2019-05-08 | — | — | EP | disclosed |