Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | S1PR4 | O95977 | 2/20 | 0.30 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.30 |
| ▸ | S1PR5 | Q9H228 | 2/20 | 0.30 |
| ▸ | MME | P08473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709423 | 0.90 | ACHE (0.30) | ACHE | |
| SCHEMBL1709502 | 0.85 | ESR2 (0.35) | — | |
| SCHEMBL10033138 | 0.84 | SIGMAR1 (0.42) | — | |
| SCHEMBL1709366 | 0.82 | L3MBTL1 (0.31) | — | |
| SCHEMBL1709403 | 0.81 | HTR2C (0.34) | — | |
| SCHEMBL1709443 | 0.81 | HTR2C (0.34) | — | |
| SCHEMBL1709494 | 0.80 | HTR2C (0.35) | — | |
| SCHEMBL10033139 | 0.77 | SIGMAR1 (0.39) | — | |
| SCHEMBL1709411 | 0.77 | SIGMAR1 (0.31) | — | |
| SCHEMBL1709413 | 0.76 | MDM2 (0.41) | — |
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-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |