Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 4/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 4/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23139760 | 1.00 | HDAC4 (0.39) | HDAC4HDAC6ALDH1A1USP2NPSR1 | |
| SCHEMBL23139207 | 1.00 | HDAC4 (0.39) | HDAC4HDAC6ALDH1A1USP2NPSR1 | |
| SCHEMBL23139740 | 1.00 | HDAC4 (0.39) | HDAC4HDAC6ALDH1A1USP2NPSR1 | |
| SCHEMBL23139724 | 1.00 | HDAC4 (0.39) | HDAC4HDAC6ALDH1A1USP2NPSR1 | |
| SCHEMBL22729446 | 0.87 | ALDH1A1 (0.40) | ALDH1A1USP2NPSR1MEN1GAA | |
| SCHEMBL22729612 | 0.87 | ALDH1A1 (0.40) | ALDH1A1USP2NPSR1MEN1GAA | |
| SCHEMBL22729728 | 0.87 | ALDH1A1 (0.40) | ALDH1A1USP2NPSR1MEN1GAA | |
| SCHEMBL23116405 | 0.87 | ALDH1A1 (0.40) | ALDH1A1USP2NPSR1MEN1GAA | |
| SCHEMBL23116406 | 0.87 | ALDH1A1 (0.40) | ALDH1A1USP2NPSR1MEN1GAA | |
| SCHEMBL22729602 | 0.83 | ALDH1A1 (0.42) | ALDH1A1USP2NPSR1MEN1GAA |
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 |