Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.63 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | PKM | P14618 | 6/20 | 0.53 |
| ▸ | CTSL | P07711 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.50 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL14724277 | 0.83 | HTT (0.55) | HTTSMN1; SMN2ALDH1A1PKMCTSL | |
| SCHEMBL14982877 | 0.82 | PKM (0.61) | HTTSMN1; SMN2ALDH1A1PKMGAA | |
| SCHEMBL12285289 | 0.79 | HTT (0.62) | HTTSMN1; SMN2ALDH1A1PKMCTSL | |
| SCHEMBL14982882 | 0.79 | HTT (0.61) | HTTSMN1; SMN2ALDH1A1PKMCTSL | |
| SCHEMBL14724326 | 0.78 | HTT (0.60) | HTTSMN1; SMN2ALDH1A1PKMCTSL | |
| SCHEMBL20908866 | 0.77 | GAA (0.65) | HTTSMN1; SMN2ALDH1A1PKMGAA | |
| SCHEMBL12285715 | 0.76 | HTT (0.58) | HTTSMN1; SMN2ALDH1A1PKMCTSL | |
| SCHEMBL20908865 | 0.76 | PKM (0.65) | HTTSMN1; SMN2PKMLMNA | |
| SCHEMBL20908792 | 0.75 | PKM (0.67) | HTTSMN1; SMN2ALDH1A1PKMKEAP1 | |
| SCHEMBL28349163 | 0.75 | HTT (0.56) | HTTSMN1; SMN2ALDH1A1PKMCTSL |
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-2562157-A1 | HETEROARYL (ALKYL) DITHIOCARBAMATE COMPOUNDS, PREPARATION METHODS AND USES THEREOF | Peking University (CN) | 2013-02-27 | — | — | EP | disclosed |