Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3287967 | 0.88 | ALDH1A1 (0.44) | ALDH1A1KDM4ELMNAPKMBCHE | |
| SCHEMBL1289738 | 0.84 | ALDH1A1 (0.47) | ALDH1A1KDM4ELMNAPKMBCHE | |
| Hydrochloric Acid SCHEMBL1289689 | 0.82 | ALDH1A1 (0.46) | ALDH1A1KDM4ELMNAPKMBCHE | |
| SCHEMBL13058298 | 0.80 | BCHE (0.50) | ALDH1A1KDM4EPKMBCHEHTT | |
| SCHEMBL1053598 | 0.80 | BCHE (0.50) | ALDH1A1KDM4EPKMBCHEHTT | |
| SCHEMBL667289 | 0.80 | ALDH1A1 (0.33) | ALDH1A1KDM4ELMNABCHEKMT2A | |
| SCHEMBL9998285 | 0.78 | GLI1 (0.34) | BCHE | |
| SCHEMBL21362892 | 0.78 | BCHE (0.49) | ALDH1A1KDM4EPKMBCHEHTT | |
| SCHEMBL3628742 | 0.78 | BCHE (0.49) | ALDH1A1KDM4EPKMBCHEHTT | |
| SCHEMBL13201334 | 0.77 | ALDH1A1 (0.43) | ALDH1A1KDM4ELMNAPKMBCHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1414813-A1 | 1,2,4-TRIOXOLANE ANTIMALARIALS | Medicines for Malaria Venture (CH) | 2004-05-06 | — | — | EP | disclosed |
| WO-2003000676-A1 | 1,2,4-TRIOXOLANE ANTIMALARIALS | MEDICINES FOR MALARIA VENTURE (CH) | 2003-01-03 | — | — | WO | disclosed |
| US-6486199-B1 | Spiro and dispiro 1,2,4-trioxolane antimalarials | MEDICINES FOR MALARIA VENTURE MMV INTERNATIONAL CENTRE COINTRIN (CH) | 2002-11-26 | — | — | US | disclosed |