Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 3/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MPL | P40238 | 2/20 | 0.33 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28877411 | 0.88 | HSD17B10 (0.37) | ALDH1A1HSD17B10HPGDLMNAMPL | |
| SCHEMBL28877384 | 0.86 | GRM1 (0.49) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL28877422 | 0.85 | HSD17B10 (0.40) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL28877466 | 0.85 | HSD17B10 (0.40) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL28957909 | 0.83 | GRM1 (0.39) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL28877438 | 0.82 | ALDH1A1 (0.39) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL23796606 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL30031345 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HSD17B10KDM4EHPGDGRM1 | |
| SCHEMBL23796273 | 0.72 | ALDH1A1 (0.40) | ALDH1A1HSD17B10KDM4EHPGDCASP1 | |
| SCHEMBL30032370 | 0.72 | ALDH1A1 (0.40) | ALDH1A1HSD17B10KDM4EHPGDCASP1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115279730-A | 2, 5-or 2, 6-disubstituted hydroquinone derivatives having at least one carboxyl, sulfo or amido group useful as medicaments | OM药物公司 | 2022-11-01 | — | — | CN | claimed |