Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.31 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.31 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.31 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.31 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.31 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.31 |
| ▸ | AKR1C2 | P52895 | 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 | |
|---|---|---|---|---|
| SCHEMBL3309062 | 0.82 | KIF11 (0.39) | KIF11ALDH1A3ALDH1A1 | |
| SCHEMBL27977385 | 0.81 | KIF11 (0.38) | KIF11ALDH1A3ALDH1A1GRIA1GRIA2 | |
| SCHEMBL7814448 | 0.78 | APEX1 (0.45) | ALDH1A3ALDH1A1ALDH3A1 | |
| SCHEMBL6515872 | 0.77 | KIF11 (0.43) | KIF11ALDH1A1GRIA1GRIA2GRIA3 | |
| SCHEMBL6856881 | 0.76 | KIF11 (0.46) | KIF11ALDH1A1GRIA1GRIA2GRIA3 | |
| SCHEMBL7147339 | 0.76 | KIF11 (0.51) | KIF11ALDH1A3ALDH1A1GRIA1GRIA2 | |
| SCHEMBL5546389 | 0.76 | KIF11 (0.47) | KIF11ALDH1A3ALDH1A1ALDH3A1NOTUM | |
| SCHEMBL29417742 | 0.76 | KIF11 (0.51) | KIF11ALDH1A3ALDH1A1GRIA1GRIA2 | |
| SCHEMBL16610339 | 0.75 | EIF2AK2 (0.47) | ALDH1A1AKR1C3AKR1C2 | |
| SCHEMBL816357 | 0.74 | KIF11 (0.44) | KIF11GRIA1GRIA2GRIA3GRIA4 |
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-2015043522-A1 | TRIFLUOROMETHYL-CONTAINING AMIDE ALKALOID, MANUFACTURING METHOD AND PHARMACEUTICAL USE THEREOF | 天士力制药集团股份有限公司 | 2015-04-02 | — | — | WO | disclosed |