Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TOP2A | P11388 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | MGAM | O43451 | 1/20 | 0.43 |
| ▸ | SI | P14410 | 1/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 5/20 | 0.42 |
| ▸ | HPGD | P15428 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | STAT1 | P42224 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL28823297 | 0.85 | MAPT (0.51) | ALDH1A1NPSR1GAAMGAMSI | |
| SCHEMBL28823196 | 0.85 | ALDH1A1 (0.56) | ALDH1A1NPSR1GAAKMT2AMEN1 | |
| SCHEMBL28037536 | 0.82 | ALDH1A1 (0.47) | ALDH1A1NPSR1GAAKMT2AMEN1 | |
| SCHEMBL29952780 | 0.72 | ALDH1A1 (0.63) | ALDH1A1NPSR1GAAKMT2AMEN1 | |
| SCHEMBL31690655 | 0.69 | TOP2A (0.82) | TOP2AALDH1A1KMT2AMEN1HTT | |
| SCHEMBL28037866 | 0.67 | GAA (0.68) | TOP2AALDH1A1GAAMGAMSI | |
| SCHEMBL5180992 | 0.66 | TOP2A (1.00) | TOP2ANPSR1KMT2AMEN1HTT | |
| SCHEMBL5180987 | 0.66 | TOP2A (1.00) | TOP2ANPSR1KMT2AMEN1HTT | |
| SCHEMBL6965148 | 0.65 | ALDH1A1 (0.62) | ALDH1A1NPSR1GAAKMT2AMEN1 | |
| SCHEMBL13611503 | 0.64 | TOP2A (1.00) | TOP2AALDH1A1KMT2AMEN1HTT |
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-105017197-A | Semicarbazone compound preparation method and application in biomedicine | UNIV HUAZHONG NORMAL | 2015-11-04 | — | — | CN | disclosed |