Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.65 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA4 | P22748 | 2/20 | 0.52 |
| ▸ | CA5A | P35218 | 2/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL1716144 | 0.85 | CA12 (0.55) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL10537367 | 0.84 | CYP1A2 (0.60) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL13534110 | 0.83 | SMN1; SMN2 (0.73) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL2538688 | 0.80 | CYP1A2 (0.72) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL12456081 | 0.80 | CYP1A2 (0.67) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL21874406 | 0.80 | SMN1; SMN2 (0.73) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL27708716 | 0.80 | SMN1; SMN2 (0.51) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL8697392 | 0.79 | SMN1; SMN2 (1.00) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL6045661 | 0.79 | SMN1; SMN2 (0.53) | SMN1; SMN2CA12CA1CA2CA4 | |
| SCHEMBL2534556 | 0.79 | CYP1A2 (0.70) | SMN1; SMN2CA12CA1CA2CA4 |
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-2455377-A1 | Synthesis of fentanyl analogs | hameln rds gmbh (DE) | 2012-05-23 | — | — | EP | disclosed |