Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 4/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 7/20 | 0.34 |
| ▸ | MPO | P05164 | 1/20 | 0.33 |
| ▸ | NMT2 | O60551 | 1/20 | 0.33 |
| ▸ | NMT1 | P30419 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL29128488 | 0.88 | L3MBTL1 (0.43) | ALDH1A1KDM4E | |
| SCHEMBL29128388 | 0.86 | NR3C2 (0.34) | ALDH1A1SLC6A4TRPA1MPONMT2 | |
| SCHEMBL29128245 | 0.79 | L3MBTL1 (0.40) | ALDH1A1KDM4ELMNATSHR | |
| SCHEMBL29125728 | 0.78 | ALDH1A1 (0.58) | ALDH1A1KDM4ELMNAALOX15TSHR | |
| SCHEMBL29128218 | 0.78 | LMNA (0.33) | ALDH1A1KDM4ELMNA | |
| SCHEMBL29128167 | 0.78 | ALDH1A1 (0.36) | ALDH1A1KDM4ELMNAHTR1ASLC6A4 | |
| SCHEMBL29128301 | 0.77 | HTR1A (0.31) | HTR1A | |
| SCHEMBL29128514 | 0.75 | ALDH1A1 (0.51) | ALDH1A1KDM4ELMNA | |
| SCHEMBL29128225 | 0.74 | DRD4 (0.40) | ALDH1A1KDM4ELMNATSHR | |
| SCHEMBL29128438 | 0.74 | DRD2 (0.41) | ALDH1A1LMNA |
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 |