Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 2/20 | 0.32 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL30667121 | 0.78 | CYP2A6 (0.35) | ACHENOTUM | |
| SCHEMBL5953457 | 0.78 | CYP2A6 (0.35) | ACHENOTUM | |
| SCHEMBL1319720 | 0.75 | TRPA1 (0.41) | — | |
| SCHEMBL1452615 | 0.75 | ADRA2A (0.36) | NOTUM | |
| SCHEMBL12122310 | 0.75 | — | — | |
| SCHEMBL31359427 | 0.75 | TRPA1 (0.41) | — | |
| SCHEMBL4275973 | 0.73 | PTGS2 (0.32) | DRD2DRD3 | |
| SCHEMBL12319663 | 0.73 | TAAR1 (0.46) | DRD2DRD3 | |
| SCHEMBL18033909 | 0.72 | — | — | |
| SCHEMBL5953568 | 0.72 | GABRA1 (0.39) | DRD2DRD3 |
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-3318557-A2 | QUINOLONE COMPOUND | Otsuka Pharmaceutical Co., Ltd. (JP) | 2018-05-09 | — | — | EP | disclosed |