Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 1/20 | 0.46 |
| ▸ | PGK2 | P07205 | 1/20 | 0.46 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | TKT | P29401 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | HTR1D | P28221 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 3/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.30 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL15725313 | 0.84 | PGK1 (0.37) | PGK1PGK2SLC11A2ALDH1A1TSHR | |
| SCHEMBL9508344 | 0.81 | ACHE (0.37) | PGK1PGK2ALDH1A1TSHRHTT | |
| SCHEMBL2382572 | 0.80 | HTR1D (0.39) | PGK1PGK2SLC11A2ALDH1A1TSHR | |
| SCHEMBL555490 | 0.79 | HRH3 (0.47) | ALDH1A1TSHRHTTHTR1DGAA | |
| SCHEMBL7708095 | 0.78 | PGK1 (0.50) | PGK1PGK2SLC11A2ALDH1A1HPGD | |
| SCHEMBL7648217 | 0.77 | ALDH1A1 (0.38) | ALDH1A1TSHRHTTHPGDHSD17B10 | |
| SCHEMBL13631462 | 0.75 | HTR1D (0.34) | PGK1PGK2ALDH1A1TSHRHTT | |
| SCHEMBL3859523 | 0.75 | HTR1D (0.38) | PGK1PGK2ALDH1A1TSHRHTT | |
| SCHEMBL19126573 | 0.75 | MEN1 (0.35) | ALDH1A1TSHRHTTHTR1DCYP3A4 | |
| SCHEMBL19126702 | 0.75 | GAA (0.38) | PGK1PGK2ALDH1A1TSHRHTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2068855-A2 | AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008151288-A2 | AROMATIC AND HETEROAROMATIC COMPOUNDS USEFUL IN TREATING IRON DISORDERS | XENON PHARMACEUTICALS INC. (CA) | 2008-12-11 | — | — | WO | disclosed |