Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | TYR | P14679 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 6/20 | 0.41 |
| ▸ | MME | P08473 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | ACE | P12821 | 1/20 | 0.39 |
| ▸ | CPA1 | P15085 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8079441 | 1.00 | SMN1; SMN2 (0.50) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| SCHEMBL8079436 | 1.00 | SMN1; SMN2 (0.50) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| Trifluoroacetic Acid SCHEMBL7349072 | 0.89 | SMN1; SMN2 (0.43) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| SCHEMBL12514588 | 0.83 | PLG (0.48) | SMN1; SMN2MMEACECPA1ACE2 | |
| SCHEMBL3551870 | 0.81 | TYR (0.44) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| SCHEMBL10513380 | 0.81 | TYR (0.44) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| SCHEMBL753926 | 0.81 | TYR (0.44) | SMN1; SMN2TYRTSHRMMEALDH1A1 | |
| SCHEMBL8253529 | 0.80 | SMN1; SMN2 (0.55) | SMN1; SMN2TSHRALDH1A1MAPTKDM4E | |
| SCHEMBL5551991 | 0.80 | SMN1; SMN2 (0.47) | SMN1; SMN2TYRTSHRALDH1A1MAPT | |
| SCHEMBL6900418 | 0.80 | SMN1; SMN2 (0.51) | SMN1; SMN2TSHRALDH1A1MAPTKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3265448-A1 | RILUZOLE PRODRUGS AND THEIR USE | Biohaven Pharmaceutical Holding Company Ltd. (US) | 2018-01-10 | — | — | EP | disclosed |
| WO-2016140879-A9 | RILUZOLE PRODRUGS AND THEIR USE | BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) | 2016-11-03 | — | — | WO | disclosed |