Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.54 |
| ▸ | CYP1A1 | P04798 | 11/20 | 0.52 |
| ▸ | CYP1B1 | Q16678 | 11/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 10/20 | 0.52 |
| ▸ | CSNK2A2 | P19784 | 2/20 | 0.52 |
| ▸ | CSNK2B | P67870 | 2/20 | 0.52 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.52 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.49 |
| ▸ | PRKDC | P78527 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.49 |
| ▸ | ABCC1 | P33527 | 2/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.49 |
| ▸ | PDE5A | O76074 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL15676498 | 0.79 | CYP3A4 (0.67) | CYP3A4TSHRCYP2C19CYP1A1CYP1B1 | |
| SCHEMBL4649417 | 0.75 | CYP1B1 (0.63) | CYP3A4TSHRCYP2C19CYP1A1CYP1B1 | |
| SCHEMBL7380906 | 0.74 | CYP3A4 (0.64) | MCL1CYP3A4TSHRCYP2C19CYP1A1 | |
| SCHEMBL14708624 | 0.71 | MCL1 (1.00) | MCL1CYP3A4TSHRCYP2C19CYP1A1 | |
| SCHEMBL12023067 | 0.71 | CYP1A2 (0.52) | TSHRCYP2C19CYP1A2TDP1KDM4E | |
| SCHEMBL5432584 | 0.70 | ALOX5 (0.57) | CYP3A4CYP2C19TDP1TP53CYP2D6 | |
| SCHEMBL1319784 | 0.69 | PRKDC (0.55) | MCL1CYP3A4CYP2C19CYP1A1CYP1B1 | |
| SCHEMBL29677981 | 0.69 | PRKDC (0.55) | MCL1CYP3A4CYP2C19CYP1A1CYP1B1 | |
| SCHEMBL7374618 | 0.68 | ALDH1A1 (0.82) | CYP3A4TSHRCYP2C19CYP1A1CYP1B1 | |
| SCHEMBL12023086 | 0.68 | ALDH1A1 (0.48) | TSHRCYP2C19CYP1A2KDM4EALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1115718-A1 | HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-18 | — | — | EP | disclosed |
| WO-2000017184-A1 | HYDROXYFLAVONE DERIVATIVES AS TAU PROTEIN KINASE 1 INHIBITORS | MITSUBISHI CHEMICAL CORPORATION (JP) | 2000-03-30 | — | — | WO | disclosed |