Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYR | P14679 | 5/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 1/20 | 0.34 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RUNX1 | Q01196 | 1/20 | 0.33 |
| ▸ | CBFB | Q13951 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Deferitrin SCHEMBL663744 | 1.00 | TYR (0.35) | TYRALDH1A1ALOX5CA12CA1 | |
| Deferitrin SCHEMBL1272026 | 1.00 | TYR (0.35) | TYRALDH1A1ALOX5CA12CA1 | |
| SCHEMBL5525608 | 0.90 | MAPT (0.36) | ALDH1A1ALOX5CA12CA1CA2 | |
| SCHEMBL3305314 | 0.90 | MAPT (0.36) | ALDH1A1ALOX5CA12CA1CA2 | |
| SCHEMBL14028919 | 0.89 | TYR (0.37) | TYRALDH1A1HSD17B1MAOBKDM4E | |
| SCHEMBL14028916 | 0.89 | TYR (0.37) | TYRALDH1A1HSD17B1MAOBKDM4E | |
| SCHEMBL11963155 | 0.87 | MEN1 (0.35) | MAPTHPGD | |
| SCHEMBL3301476 | 0.87 | NPC1 (0.40) | TYRALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL3301483 | 0.87 | NPC1 (0.40) | TYRALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL6314483 | 0.86 | KDM4E (0.40) | ALDH1A1CA12CA1CA2CA7 |
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-2016154547-A1 | USE OF METAL CHELATORS IN MANAGING INFECTIOUS DISEASES | UNIVERSITY OF FLORIDA RESEARCH FOUNDATION, INCORPORATED (US) | 2016-09-29 | — | — | WO | disclosed |