Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 18/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27739998 | 0.79 | GRIN1 (0.51) | EPHX2 | |
| SCHEMBL28058028 | 0.77 | MEN1 (0.47) | EPHX2ALDH1A1 | |
| SCHEMBL1082075 | 0.77 | EPHX2 (0.50) | EPHX2HTT | |
| SCHEMBL28058016 | 0.76 | EPHX2 (0.44) | EPHX2ALDH1A1 | |
| SCHEMBL19798760 | 0.74 | EPHX2 (0.58) | EPHX2HTT | |
| SCHEMBL3188537 | 0.72 | GRIN2D (0.50) | EPHX2 | |
| SCHEMBL23934062 | 0.70 | GRIN2D (0.48) | EPHX2HTT | |
| SCHEMBL11922812 | 0.70 | EPHX2 (0.49) | EPHX2 | |
| SCHEMBL28057903 | 0.69 | LMNA (0.46) | EPHX2ALDH1A1 | |
| SCHEMBL19798464 | 0.68 | ALDH1A1 (0.57) | EPHX2ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101597196-B | Improved drug candidate and preparation method thereof | JIYAKETA CO., LTD. (CH) | 2016-05-04 | — | — | CN | disclosed |