Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AOC3 | Q16853 | 2/20 | 0.31 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.31 |
| ▸ | CCR5 | P51681 | 1/20 | 0.31 |
| ▸ | TOP2A | P11388 | 6/20 | 0.31 |
| ▸ | TOP2B | Q02880 | 6/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | CHRM4 | P08173 | 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 | |
|---|---|---|---|---|
| SCHEMBL3573543 | 0.90 | AOC3 (0.33) | AOC3FFAR4CCR5TOP2ATOP2B | |
| SCHEMBL3573544 | 0.76 | AOC3 (0.33) | AOC3CCR5TOP2ATOP2B | |
| SCHEMBL1096395 | 0.75 | ESR1 (0.34) | FFAR4CCR5 | |
| SCHEMBL1096396 | 0.74 | ESR1 (0.33) | CCR5 | |
| SCHEMBL3575203 | 0.73 | CASR (0.35) | CCR5 | |
| SCHEMBL3573546 | 0.72 | CASR (0.39) | — | |
| SCHEMBL1094613 | 0.70 | ESR1 (0.34) | FFAR4CCR5 | |
| SCHEMBL1094614 | 0.69 | ESR1 (0.33) | CCR5 | |
| SCHEMBL3572894 | 0.68 | CASR (0.35) | — | |
| SCHEMBL1096063 | 0.65 | CASR (0.39) | FFAR4CCR5 |
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 |
|---|---|---|---|---|---|---|---|
| US-8153658-B2 | Piperidine derivative or salt thereof | ASTELLAS PHARMA, INC. (JP) | 2012-04-10 | — | — | US | disclosed |