Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FHIT | P49789 | 1/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 14/20 | 0.68 |
| ▸ | MAPT | P10636 | 11/20 | 0.68 |
| ▸ | HPGD | P15428 | 9/20 | 0.68 |
| ▸ | GAA | P10253 | 8/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.60 |
| ▸ | RAB9A | P51151 | 3/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | GRM6 | O15303 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28267388 | 0.93 | FHIT (0.83) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL13343389 | 0.91 | FHIT (1.00) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL27969857 | 0.89 | ALDH1A1 (0.85) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL1622309 | 0.82 | FHIT (0.77) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL223094 | 0.81 | ALDH1A1 (1.00) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL14708470 | 0.81 | FHIT (0.74) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL24811161 | 0.79 | FHIT (0.72) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL5119925 | 0.79 | FHIT (0.72) | FHITALDH1A1MAPTHPGDGAA | |
| SCHEMBL9097179 | 0.79 | FHIT (0.72) | FHITALDH1A1MAPTHPGDGAA | |
| Bromide SCHEMBL28146660 | 0.79 | FHIT (0.51) | FHITALDH1A1MAPTHPGDGAA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106749317-B | A kind of azepine penthienate [2,3-d] pyrimidone benzsulfamide analog derivative and purposes | 中国科学院新疆理化技术研究所 | 2019-01-01 | — | — | CN | disclosed |
| WO-2008063668-A1 | HETEROBICYCLIC METALLOPROTEASE INHIBITORS | ALANTOS PHARMACEUTICALS HOLDING, INC. (US) | 2008-05-29 | — | — | WO | disclosed |