Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 5/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.41 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.40 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.40 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL22591163 | 0.87 | MEN1 (0.45) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL22591158 | 0.87 | HTT (0.45) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL20289582 | 0.84 | MAPT (0.46) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL20289632 | 0.81 | MAPT (0.44) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL24170425 | 0.80 | HTT (0.43) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL25543365 | 0.78 | MEN1 (0.43) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL27980498 | 0.77 | SMN1; SMN2 (0.68) | MAPTHTTALDH1A1MEN1KMT2A | |
| SCHEMBL19700727 | 0.76 | SMN1; SMN2 (0.46) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL22591149 | 0.75 | MAPT (0.44) | MAPTHTTALDH1A1NPC1MAPK1 | |
| SCHEMBL30274613 | 0.74 | ALDH1A1 (0.47) | MAPTHTTALDH1A1NPC1MAPK1 |
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-3763717-B1 | PYRIDO[4,3-D][1,3]OXAZIN-2-ONE COMPOUNDS AS MUTANT IDH1 AND IDH2 INHIBITORS | LILLY CO ELI (US) | 2023-03-08 | — | — | EP | disclosed |