Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ACACB | O00763 | 7/20 | 0.40 |
| ▸ | IDH1 | O75874 | 3/20 | 0.40 |
| ▸ | IDH2 | P48735 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP3A5 | P20815 | 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 | |
|---|---|---|---|---|
| SCHEMBL20289382 | 1.00 | MAPT (0.42) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL21799063 | 0.88 | ACACB (0.43) | ACACBIDH1IDH2CNR1 | |
| SCHEMBL21799062 | 0.88 | ACACB (0.43) | ACACBIDH1IDH2CNR1 | |
| SCHEMBL21378569 | 0.88 | MAPT (0.45) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL20289586 | 0.88 | MAPT (0.45) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL19700725 | 0.88 | MAPT (0.45) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL20289632 | 0.87 | MAPT (0.44) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL31452023 | 0.87 | MAPT (0.41) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL20289383 | 0.87 | SMN1; SMN2 (0.46) | MAPTALDH1A1NPC1MAPK1HTT | |
| SCHEMBL31452104 | 0.85 | MAPT (0.40) | MAPTALDH1A1NPC1MAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| CN-115109075-A | Mutant IDH1 and IDH2 inhibitors | 伊莱利利公司 | 2022-09-27 | — | — | CN | disclosed |
| CN-110072867-B | 7-phenylethylamino-4H-pyrimido [4,5-D ] [1,3] oxazin-2-one compounds as inhibitors of mutant IDH1 and IDH2 | 伊莱利利公司 | 2022-07-08 | — | — | CN | disclosed |