Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 2/20 | 0.40 |
| ▸ | TDO2 | P48775 | 2/20 | 0.40 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 1/20 | 0.36 |
| ▸ | CCR1 | P32246 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | GFER | P55789 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | EEF2K | O00418 | 1/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL1023334 | 1.00 | IDO1 (0.40) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL11566406 | 0.76 | ALDH1A1 (0.35) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL1629226 | 0.76 | ALDH1A1 (0.47) | IDO1TDO2CCR1ALDH1A1TDP1 | |
| SCHEMBL4910575 | 0.76 | IDO1 (0.37) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL10907202 | 0.74 | PARP10 (0.39) | MAPT | |
| SCHEMBL3495437 | 0.74 | TSHR (0.50) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL2339911 | 0.74 | ALDH1A1 (0.38) | IDO1TDO2CES2CES1ALDH1A1 | |
| SCHEMBL7868609 | 0.74 | IDO1 (0.40) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL27782003 | 0.74 | TRPA1 (0.50) | IDO1TDO2CES2CES1CCR1 | |
| SCHEMBL2163400 | 0.74 | TSHR (0.50) | IDO1TDO2CES2CES1CCR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3362445-B1 | OXADIAZOLE AMINE DERIVATIVE COMPOUNDS AS HISTONE DEACETYLASE 6 INHIBITOR, AND THE PHARMACEUTICAL COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP (KR) | 2023-01-25 | — | — | EP | disclosed |