Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | GAA | P10253 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.40 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP7 | P55210 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL15004839 | 0.94 | HPGD (0.51) | ALDH1A1GAAMAPTHPGDNOTUM | |
| SCHEMBL28813991 | 0.87 | NOTUM (0.49) | ALDH1A1GAAMAPTHPGDNOTUM | |
| SCHEMBL28371343 | 0.85 | HPGD (0.47) | ALDH1A1GAAHPGDNOTUMMAPK1 | |
| SCHEMBL28079273 | 0.85 | MAPK1 (0.53) | ALDH1A1GAAMAPTHPGDMAPK1 | |
| SCHEMBL15005391 | 0.80 | ALDH1A1 (0.70) | ALDH1A1GAAMAPTHPGDMAPK8 | |
| SCHEMBL15004863 | 0.78 | ALDH1A1 (0.71) | ALDH1A1GAAMAPTHPGDMAPK1 | |
| SCHEMBL15004766 | 0.78 | MAPT (0.49) | ALDH1A1GAAMAPTHPGDMAPK1 | |
| SCHEMBL15004854 | 0.78 | MAPK1 (0.58) | ALDH1A1GAAMAPTHPGDMAPK1 | |
| SCHEMBL21465564 | 0.77 | MAPK8 (0.47) | ALDH1A1GAAMAPTHPGDMAPK1 | |
| SCHEMBL15005275 | 0.76 | NPC1 (0.51) | ALDH1A1GAAMAPTHPGDMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104011019-B | Azole derivatives | 莱斯特大学 | 2016-08-24 | — | — | CN | disclosed |