Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP3 | O14638 | 5/20 | 0.47 |
| ▸ | ALPL | P05186 | 5/20 | 0.47 |
| ▸ | XIAP | P98170 | 5/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | F12 | P00748 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL753657 | 0.83 | TSHR (0.58) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| Cyclohexane SCHEMBL8747257 | 0.79 | TSHR (0.53) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| Nitrous Acid SCHEMBL14661057 | 0.77 | TSHR (0.51) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| SCHEMBL211373 | 0.74 | — | — | |
| Fluoride SCHEMBL31379727 | 0.72 | — | — | |
| SCHEMBL1862337 | 0.68 | TSHR (0.62) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| SCHEMBL6049124 | 0.68 | TSHR (0.39) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| SCHEMBL3739579 | 0.67 | TSHR (0.60) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| SCHEMBL4457538 | 0.67 | TSHR (0.60) | ENPP3ALPLXIAPTSHRALDH1A1 | |
| Acetic Acid SCHEMBL10353741 | 0.66 | TSHR (0.50) | ENPP3ALPLXIAPTSHRALDH1A1 |
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-2266958-B1 | Antiviral agent | SHIONOGI & CO (JP) | 2017-03-15 | — | — | EP | disclosed |