Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | GAA | P10253 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | TLR4 | O00206 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | CTSL | P07711 | 1/20 | 0.54 |
| ▸ | CTSB | P07858 | 1/20 | 0.54 |
| ▸ | CTSK | P43235 | 1/20 | 0.54 |
| ▸ | DPP4 | P27487 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.52 |
| ▸ | CPB1 | P15086 | 2/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL5442669 | 0.96 | EPHX1 (0.68) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL5442666 | 0.96 | EPHX1 (0.68) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL29492533 | 0.96 | EPHX1 (0.68) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL5442663 | 0.96 | EPHX1 (0.68) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL19408982 | 0.94 | ALDH1A1 (0.70) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL10007474 | 0.90 | EPHX1 (0.62) | EPHX1ALDH1A1GAATSHRTLR4 | |
| Cyclobutylcarbamic Acid Benzyl Ester SCHEMBL332814 | 0.90 | EPHX1 (0.76) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL16665079 | 0.89 | EPHX1 (0.61) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL17207590 | 0.89 | EPHX1 (0.61) | EPHX1ALDH1A1GAATSHRTLR4 | |
| SCHEMBL26346079 | 0.89 | EPHX1 (0.61) | EPHX1ALDH1A1GAATSHRTLR4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104922128-B | Inhibitors of influenza virus replication | 沃泰克斯药物股份有限公司 | 2019-12-20 | — | — | CN | disclosed |
| CN-110540538-A | Inhibitors of influenza virus replication | VERTEX PHARMA | 2019-12-06 | — | — | CN | disclosed |