Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | PGD | P52209 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL20082329 | 1.00 | TP53 (0.47) | TP53CYP3A4ALDH1A1PGDMAPK1 | |
| SCHEMBL20082328 | 1.00 | TP53 (0.47) | TP53CYP3A4ALDH1A1PGDMAPK1 | |
| SCHEMBL20082320 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL20091183 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL21371146 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL20091169 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL8626031 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL20082335 | 0.78 | TSHR (0.41) | ALDH1A1PGDTSHR | |
| SCHEMBL16429649 | 0.75 | TP53 (0.60) | TP53CYP3A4ALDH1A1TSHRMGLL | |
| SCHEMBL21371144 | 0.75 | PGD (0.35) | ALDH1A1PGDMAPK1TSHRNPSR1 |
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-3529238-B1 | BIS-DIOX(OL)ANE COMPOUNDS | COOEPERATIE KONINKLIJKE COSUN U A (NL) | 2021-07-07 | — | — | EP | disclosed |