Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.35 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL23093241 | 1.00 | ALDH1A3 (0.42) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL2615817 | 0.81 | CCR1 (0.58) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL2609352 | 0.79 | ALDH1A3 (0.40) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL29802659 | 0.78 | JAK2 (0.42) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL23093234 | 0.78 | JAK2 (0.42) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL28670824 | 0.76 | RAB9A (0.62) | ALDH1A3ALDH1A1POLBMAPTHPGD | |
| SCHEMBL23093432 | 0.76 | HDAC1 (0.36) | ALDH1A1POLBMAPTHPGDHSD17B10 | |
| SCHEMBL29802408 | 0.76 | HDAC1 (0.36) | ALDH1A1POLBMAPTHPGDHSD17B10 | |
| SCHEMBL3768 | 0.76 | MEN1 (0.68) | ALDH1A1POLBMAPTHPGDHSD17B10 | |
| SCHEMBL23111084 | 0.75 | ALDH1A1 (0.43) | ALDH1A1POLBMAPTHPGDHSD17B10 |
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-4027993-A1 | CYCLOOXYGENASE-2 INHIBITORS AND USES THEREOF | The Broad Institute Inc. (US) | 2022-07-20 | — | — | EP | disclosed |