Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 3/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.38 |
| ▸ | TACR1 | P25103 | 1/20 | 0.38 |
| ▸ | GLS | O94925 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20289586 | 1.00 | MAPT (0.45) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL21378569 | 1.00 | MAPT (0.45) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL20289632 | 0.91 | MAPT (0.44) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL20289697 | 0.88 | ALDH1A1 (0.47) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL22186807 | 0.88 | ALDH1A1 (0.47) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL20289382 | 0.88 | MAPT (0.42) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL19700717 | 0.88 | ALDH1A1 (0.47) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL28779159 | 0.88 | MAPT (0.42) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL21399862 | 0.87 | MAPT (0.48) | MAPTMAPK1NPC1ALDH1A1HTT | |
| SCHEMBL31452023 | 0.86 | MAPT (0.41) | MAPTMAPK1NPC1ALDH1A1HTT |
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-2017213910-A1 | MUTANT IDH1 INHIBITORS | ELI LILLY AND COMPANY (US) | 2017-12-14 | — | — | WO | disclosed |