Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.33 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | NMT2 | O60551 | 1/20 | 0.30 |
| ▸ | NMT1 | P30419 | 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 | |
|---|---|---|---|---|
| SCHEMBL29128402 | 0.86 | RAB9A (0.34) | ALDH1A1KDM4ELMNARAB9AGRM2 | |
| SCHEMBL29128488 | 0.84 | L3MBTL1 (0.43) | ALDH1A1KDM4ERAB9ATDP1MAPK1 | |
| SCHEMBL29128340 | 0.82 | ALDH1A1 (0.37) | ALDH1A1KDM4ELMNAHTT | |
| SCHEMBL29128413 | 0.79 | HTT (0.41) | ALDH1A1KDM4ELMNATDP1MAPK1 | |
| SCHEMBL29128185 | 0.79 | ALDH1A1 (0.39) | ALDH1A1KDM4ELMNAHTTSMN1; SMN2 | |
| SCHEMBL29128332 | 0.78 | ALDH1A1 (0.34) | ALDH1A1KDM4ELMNATRPA1SLC6A4 | |
| SCHEMBL29128354 | 0.77 | ALDH1A1 (0.59) | ALDH1A1KDM4ELMNATDP1MAPK1 | |
| SCHEMBL29128171 | 0.76 | SLC6A2 (0.31) | CXCR2TRPA1SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL29128345 | 0.75 | RAB9A (0.46) | ALDH1A1KDM4ELMNARAB9AHTT | |
| SCHEMBL29128234 | 0.75 | ALDH1A1 (0.40) | ALDH1A1KDM4ELMNARAB9ATDP1 |
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-117263862-A | Phenol-1, 3-oxazole/dihydroimidazole-2-ketone/thioketone compound and synthesis and application thereof | 吉首大学 | 2023-12-22 | — | — | CN | disclosed |