Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.57 |
| ▸ | CA2 | P00918 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 6/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.54 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | PLK1 | P53350 | 2/20 | 0.46 |
| ▸ | MPO | P05164 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | KDM5A | P29375 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | GFER | P55789 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | OGG1 | O15527 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL22192216 | 0.84 | NPC1 (0.64) | MAPTALDH1A1HTTNPC1POLB | |
| SCHEMBL3895936 | 0.83 | L3MBTL1 (0.61) | MAPTALDH1A1HTTPOLBRAB9A | |
| SCHEMBL2313483 | 0.82 | MAPT (0.64) | CA1CA2MAPTALDH1A1HTT | |
| Valencic Acid SCHEMBL3316632 | 0.81 | PKM (0.53) | CA1CA2MAPTALDH1A1HTT | |
| SCHEMBL8036010 | 0.80 | KDM4E (0.53) | MAPTALDH1A1HTTBLMKDM4E | |
| SCHEMBL6432999 | 0.79 | NDUFS8 (0.45) | MAPTALDH1A1HTTBLMNPC1 | |
| SCHEMBL9243185 | 0.78 | PLK1 (0.51) | MAPTALDH1A1HTTPLK1BLM | |
| SCHEMBL2636457 | 0.78 | PLK1 (0.73) | CA1CA2MAPTALDH1A1HTT | |
| SCHEMBL16343967 | 0.77 | PTPN1 (0.51) | MAPTALDH1A1HTTBLMNPC1 | |
| SCHEMBL16193119 | 0.77 | CA1 (0.66) | CA1CA2MAPTALDH1A1HTT |
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-108456157-B | 1-substituted benzoyl-4-fatty acyl semicarbazide derivatives, preparation method and application as antibacterial drugs | 中国医学科学院药物研究所 | 2021-07-20 | — | — | CN | disclosed |