Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | PKM | P14618 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | FKBP1A | P62942 | 4/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | HPGD | P15428 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | F2 | P00734 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL10144672 | 1.00 | CYP3A4 (0.64) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL7302729 | 1.00 | CYP3A4 (0.64) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL21696782 | 0.96 | FKBP1A (0.61) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL21697064 | 0.89 | ALDH1A1 (0.54) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL20111166 | 0.88 | HDAC1 (0.61) | CYP3A4CYP2C9PKMCYP2C19ALDH1A1 | |
| SCHEMBL21696527 | 0.87 | CYP3A4 (0.66) | CYP3A4CYP2C9PKMCYP2C19ALDH1A1 | |
| SCHEMBL21697246 | 0.87 | FKBP1A (0.58) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL21696758 | 0.87 | FKBP1A (0.58) | CYP3A4CYP2C9PKMCYP2C19FKBP1A | |
| SCHEMBL21696570 | 0.86 | MEN1 (0.57) | CYP3A4CYP2C9PKMCYP2C19ALDH1A1 | |
| SCHEMBL21430529 | 0.86 | CYP3A4 (0.52) | CYP3A4CYP2C9PKMCYP2C19FKBP1A |
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-2022269532-A1 | TRIAZINE DERIVATIVES FOR THE TREATMENT OF TUMOURS AND NEURODEGENERATIVE DISORDERS | UNIVERSITA' DEGLI STUDI DI MILANO (IT) | 2022-12-29 | — | — | WO | disclosed |