Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11301081 | 0.84 | THRA (0.48) | ALDH1A1ALOX15GAACNR1KMT2A | |
| SCHEMBL7322435 | 0.81 | ALDH1A1 (0.56) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| SCHEMBL29954798 | 0.81 | ALDH1A1 (0.58) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| Hydrochloric Acid SCHEMBL10411183 | 0.80 | ALDH1A1 (0.57) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| SCHEMBL6179341 | 0.80 | ALDH1A1 (0.54) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| SCHEMBL11287913 | 0.79 | ALDH1A1 (0.53) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| SCHEMBL4593938 | 0.75 | ALDH1A1 (0.49) | ALDH1A1ALOX15GAACNR1HDAC1 | |
| SCHEMBL27908866 | 0.75 | FFAR1 (0.49) | GAAMAPTGPR52 | |
| SCHEMBL3049598 | 0.75 | NPSR1 (0.38) | ALDH1A1ALOX15GAAMAPTSMN1; SMN2 | |
| SCHEMBL10411875 | 0.75 | CYP4F2 (0.53) | ALDH1A1ALOX15GAACNR1HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0043141-A1 | Pharmaceutical compositions having antiviral activity for topical administration and the use of 1-(substituted phenyl)-5-(4-morpholinyl)-1-penten-3-one compounds for the preparation of pharmaceutical compositions having an antiviral effect | MERRELL DOW PHARMACEUTICALS INC. (US) | 1982-01-06 | — | — | EP | disclosed |