Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | KLK7 | P49862 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9328825 | 0.85 | KMT2A (0.54) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL3231393 | 0.84 | HTT (0.63) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL9945858 | 0.80 | CES1 (0.58) | KMT2AALDH1A1L3MBTL1SMN1; SMN2 | |
| SCHEMBL3231401 | 0.80 | KMT2A (0.58) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL17210682 | 0.80 | CES1 (0.58) | HTTALDH1A1CYP3A4CYP2C19SMN1; SMN2 | |
| SCHEMBL31613156 | 0.78 | ALDH1A1 (0.64) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL4644036 | 0.78 | KMT2A (0.56) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL27886543 | 0.77 | ALDH1A1 (0.56) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| SCHEMBL313139 | 0.77 | HTT (0.69) | KMT2AHTTALDH1A1CYP3A4CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL7562496 | 0.77 | KDM4E (0.62) | HTTSMN1; SMN2CTBP2 |
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-2002076440-A2 | METHODS OF TREATING ALZHEIMER'S DISEASE WITH PIPERIDIN DERIVATES | ELAN PHARMACEUTICALS, INC. (US) | 2002-10-03 | — | — | WO | disclosed |