Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.53 |
| ▸ | TP53 | P04637 | 3/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 12/20 | 0.51 |
| ▸ | MEN1 | O00255 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.51 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL22754973 | 0.79 | MAPT (0.44) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL13907635 | 0.70 | NPC1 (1.00) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL1853814 | 0.70 | MAPT (0.67) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL22754851 | 0.69 | RAB9A (0.52) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL429085 | 0.68 | MAPT (0.75) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL11642433 | 0.68 | GAA (0.68) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL2565238 | 0.67 | HDAC8 (0.76) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL8770431 | 0.67 | HDAC8 (0.81) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL1663783 | 0.67 | HDAC8 (0.81) | RAB9ANPC1TP53MAPK1PKM | |
| SCHEMBL22754983 | 0.67 | MAPT (0.53) | RAB9ANPC1TP53MAPK1PKM |
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-3747885-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2020-12-09 | — | — | EP | disclosed |