Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ACACB | O00763 | 6/20 | 0.41 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21399862 | 0.87 | MAPT (0.48) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL21378605 | 0.84 | MAPT (0.53) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL21378603 | 0.84 | MAPT (0.53) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL18459333 | 0.83 | RAB9A (0.47) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL20289586 | 0.83 | MAPT (0.45) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL19700725 | 0.83 | MAPT (0.45) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL21378569 | 0.83 | MAPT (0.45) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL18459334 | 0.83 | RAB9A (0.47) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL20289632 | 0.82 | MAPT (0.44) | MAPTALDH1A1HTTNPC1MAPK1 | |
| SCHEMBL19700717 | 0.80 | ALDH1A1 (0.47) | MAPTALDH1A1HTTNPC1MAPK1 |
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-3464281-B1 | MUTANT IDH1 INHIBITORS | LILLY CO ELI (US) | 2020-07-08 | — | — | EP | disclosed |
| WO-2017213910-A1 | MUTANT IDH1 INHIBITORS | ELI LILLY AND COMPANY (US) | 2017-12-14 | — | — | WO | disclosed |