Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.43 |
| ▸ | FOLH1 | Q04609 | 5/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | GLS | O94925 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | GBA1 | P04062 | 2/20 | 0.35 |
| ▸ | TNKS | O95271 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26066647 | 0.86 | FOLH1 (0.42) | FOLH1MAOAMAOBLMNAFNTA | |
| SCHEMBL26066667 | 0.84 | HDAC1 (0.40) | HDAC1CSNK2A1FOLH1HDAC3HDAC4 | |
| SCHEMBL26066670 | 0.80 | HDAC1 (0.40) | HDAC1CSNK2A1FOLH1HDAC3HDAC4 | |
| SCHEMBL25013968 | 0.79 | FOLH1 (0.46) | HDAC1FOLH1HDAC3HDAC4HDAC7 | |
| SCHEMBL12436745 | 0.78 | CSNK2A1 (0.43) | HDAC1CSNK2A1FOLH1MAOAMAOB | |
| SCHEMBL12825187 | 0.77 | MAOA (0.42) | MAOAMAOBGBA1 | |
| SCHEMBL25938475 | 0.76 | DNM1 (0.44) | HDAC1CSNK2A1FOLH1HDAC3HDAC4 | |
| SCHEMBL23876336 | 0.75 | MAOA (0.38) | HDAC1CSNK2A1FOLH1HDAC3HDAC4 | |
| SCHEMBL25013920 | 0.75 | GBA1 (0.43) | MAOAGLSGBA1 | |
| SCHEMBL23736423 | 0.75 | HDAC1 (0.48) | HDAC1CSNK2A1FOLH1LMNAGBA1 |
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-2023154344-A1 | 2-METHYL-4',5'-DIHYDROSPIRO[PIPERIDINE-4,7'-THIENO[2,3-C]PYRAN] DERIVATIVES AS INHIBITORS OF APOL1 AND METHODS OF USING SAME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-08-17 | — | — | WO | disclosed |