Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 2/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.33 |
| ▸ | CETP | P11597 | 5/20 | 0.32 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.32 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.31 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL25875873 | 0.93 | IDO1 (0.36) | DUSP3CYP1A1CYP1B1CXCL12GAA | |
| SCHEMBL25836793 | 0.89 | KCNH2 (0.35) | KCNH2DUSP3CYP1A1CYP1B1KDM4E | |
| SCHEMBL25875884 | 0.85 | ALK (0.35) | CETP | |
| SCHEMBL25836778 | 0.83 | TDO2 (0.36) | DUSP3CYP1A1CYP1B1GAACNR1 | |
| SCHEMBL1815597 | 0.82 | KCNH2 (0.36) | KCNH2DUSP3CYP1A1CYP1B1CXCL12 | |
| SCHEMBL25876749 | 0.81 | PDK2 (0.37) | DUSP3PTPN7MAPTMEN1GAA | |
| SCHEMBL25875866 | 0.77 | PTPN1 (0.35) | KDM4EMAPTMEN1KMT2A | |
| SCHEMBL25876918 | 0.77 | PDK2 (0.36) | MEN1GAAKMT2ACNR1CNR2 | |
| SCHEMBL25876421 | 0.76 | PDK2 (0.37) | — | |
| SCHEMBL1816876 | 0.75 | IDO1 (0.39) | CYP1A1CYP1B1KDM4EMAPTGAA |
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-2023140186-A1 | PHOTOCHROMIC COMPOUND, NAPHTHOL DERIVATIVE, CURABLE COMPOSITION, OPTICAL ARTICLE, LENS, AND EYEGLASSES | 株式会社トクヤマ | 2023-07-27 | — | — | WO | disclosed |