Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKN1 | Q16512 | 1/20 | 0.47 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MGAM | O43451 | 1/20 | 0.45 |
| ▸ | SI | P14410 | 1/20 | 0.45 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.45 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.43 |
| ▸ | RELA | Q04206 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CHEK1 | O14757 | 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 | |
|---|---|---|---|---|
| SCHEMBL8277810 | 0.81 | PKN1 (0.53) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL8601951 | 0.80 | PKN1 (0.55) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL8598655 | 0.79 | PKN1 (0.53) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL7480899 | 0.78 | PKN1 (0.50) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL1013588 | 0.76 | PKN1 (0.60) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL7259082 | 0.76 | GAA (0.65) | PKN1PKN2GAAMGAMSI | |
| Dimethylamine SCHEMBL7486960 | 0.76 | PKN1 (0.56) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL9588046 | 0.75 | PARP1 (0.42) | GAARAB9ANPC1MAPTALDH1A1 | |
| SCHEMBL28467668 | 0.74 | PKN1 (0.49) | PKN1PKN2GAAMGAMSI | |
| SCHEMBL8598342 | 0.74 | GAA (0.56) | PKN1PKN2GAAMGAMSI |
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-107098846-B | N-acyl sulfonamide FBPase inhibitor, preparation method thereof, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2020-10-09 | — | — | CN | disclosed |