Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22360423 | 0.86 | HDAC1 (0.40) | ALDH1A1MAPTMEN1KMT2AHDAC1 | |
| SCHEMBL22360426 | 0.85 | KDM4E (0.45) | ALDH1A1MAPTTDP1MEN1TP53 | |
| SCHEMBL22360417 | 0.84 | HDAC1 (0.37) | ALDH1A1MAPTMEN1TP53CYP3A4 | |
| SCHEMBL22360421 | 0.82 | ALDH1A1 (0.40) | ALDH1A1MAPTMEN1ALOX15KMT2A | |
| SCHEMBL22360387 | 0.82 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2HDAC1HDAC2HDAC8 | |
| SCHEMBL22360383 | 0.79 | CTSS (0.32) | HSD17B10 | |
| SCHEMBL21652205 | 0.79 | ALDH1A1 (0.52) | ALDH1A1MAPTTDP1MEN1TP53 | |
| SCHEMBL22360425 | 0.77 | MAPT (0.44) | ALDH1A1MAPTBLMGAA | |
| SCHEMBL23923175 | 0.76 | P2RY1 (0.39) | ALDH1A1MAPTTP53SMN1; SMN2HSD17B10 | |
| SCHEMBL22360427 | 0.75 | PTGS1 (0.30) | — |
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-2020164403-A1 | 1,1-DICYANO-OXIME-ETHER COMPOUND AND APPLICATION THEREOF | 沈阳化工大学 | 2020-08-20 | — | — | WO | disclosed |