Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3C3 | Q8NEB9 | 1/20 | 0.49 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.41 |
| ▸ | FDPS | P14324 | 3/20 | 0.40 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | MMP1 | P03956 | 2/20 | 0.38 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL18322940 | 0.89 | PIK3C3 (0.49) | PIK3C3MAP4K4EPHX2HRH3CHEK2 | |
| SCHEMBL28912555 | 0.85 | GPR119 (0.51) | PIK3C3HRH3CHEK2HTT | |
| Hydrochloric Acid SCHEMBL18318253 | 0.84 | GPR119 (0.50) | PIK3C3HRH3CHEK2HTT | |
| Acetic Acid SCHEMBL18318436 | 0.84 | PIK3C3 (0.44) | PIK3C3EPHX2HRH3CHEK2FDPS | |
| SCHEMBL18319428 | 0.84 | PIK3C3 (0.47) | PIK3C3EPHX2HRH3MMP1 | |
| Hydrochloric Acid SCHEMBL18319008 | 0.83 | PIK3C3 (0.46) | PIK3C3EPHX2HRH3MMP1 | |
| SCHEMBL28566516 | 0.81 | PIK3C3 (0.42) | PIK3C3MAP4K4EPHX2HRH3CHEK2 | |
| Acetic Acid SCHEMBL30497916 | 0.80 | GPR119 (0.48) | PIK3C3HRH3CHEK2 | |
| SCHEMBL18322912 | 0.79 | HRH3 (0.44) | PIK3C3HRH3CHEK2 | |
| Hydrochloric Acid SCHEMBL18318449 | 0.78 | HRH3 (0.43) | PIK3C3HRH3CHEK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3310441-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | Cephalon, Inc. (US) | 2018-04-25 | — | — | EP | disclosed |
| WO-2016205633-A1 | 1, 4-SUBSTITUTED PIPERIDINE DERIVATIVES | CEPHALON, INC. (US) | 2016-12-22 | — | — | WO | disclosed |