Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CDC25B | P30305 | 1/20 | 0.46 |
| ▸ | CCKBR | P32239 | 2/20 | 0.45 |
| ▸ | TACR1 | P25103 | 1/20 | 0.44 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL14514594 | 0.91 | ALDH1A1 (0.53) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| SCHEMBL13227681 | 0.91 | ALDH1A1 (0.53) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| SCHEMBL16543292 | 0.90 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| SCHEMBL5019026 | 0.90 | FOLH1 (0.52) | ALDH1A1TACR1ACE | |
| SCHEMBL5206415 | 0.90 | FOLH1 (0.52) | ALDH1A1TACR1ACE | |
| Hydrochloric Acid SCHEMBL1161942 | 0.88 | FOLH1 (0.51) | ALDH1A1TACR1ACE | |
| SCHEMBL5209504 | 0.88 | PPARA (0.46) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| SCHEMBL22423631 | 0.87 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| Hydrochloric Acid SCHEMBL13386716 | 0.87 | CASP1 (0.44) | ALDH1A1KMT2AMEN1HPGDMAPK1 | |
| Hydrochloric Acid SCHEMBL13386714 | 0.87 | CASP1 (0.44) | ALDH1A1KMT2AMEN1HPGDMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021202600-A1 | SMALL MOLECULE INHIBITORS OF INFLUENZA HEMAGGLUTININ | THE SCRIPPS RESEARCH INSTITUTE (US) | 2021-10-07 | — | — | WO | disclosed |