Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 3/20 | 0.57 |
| ▸ | ITGAV | P06756 | 1/20 | 0.57 |
| ▸ | ACE | P12821 | 4/20 | 0.54 |
| ▸ | MME | P08473 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | CPA1 | P15085 | 2/20 | 0.52 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.52 |
| ▸ | CTSL | P07711 | 1/20 | 0.52 |
| ▸ | CTSB | P07858 | 1/20 | 0.52 |
| ▸ | CTSS | P25774 | 1/20 | 0.52 |
| ▸ | CTSK | P43235 | 1/20 | 0.52 |
| ▸ | TYR | P14679 | 1/20 | 0.52 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.52 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | MMP2 | P08253 | 1/20 | 0.51 |
| ▸ | MMP7 | P09237 | 1/20 | 0.51 |
| ▸ | MMP9 | P14780 | 1/20 | 0.51 |
| ▸ | MMP12 | P39900 | 1/20 | 0.51 |
| ▸ | MMP13 | P45452 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL12497357 | 1.00 | ITGB3 (0.57) | ITGB3ITGAVACEMMEL3MBTL1 | |
| SCHEMBL9554401 | 1.00 | ITGB3 (0.57) | ITGB3ITGAVACEMMEL3MBTL1 | |
| Phenylalanine SCHEMBL12496443 | 0.92 | ALPI (0.55) | ITGB3ITGAVACEITGA2BALDH1A1 | |
| SCHEMBL12496425 | 0.89 | NMBR (0.51) | ITGB3ITGAVCTSLCTSBCTSS | |
| SCHEMBL22632044 | 0.87 | MMP1 (0.59) | CTSLCTSBCTSSCTSKMMP2 | |
| SCHEMBL6900423 | 0.87 | TP53 (0.51) | ITGB3ITGAVCTSLCTSBCTSS | |
| SCHEMBL10087930 | 0.87 | CTSK (0.58) | CTSLCTSBCTSSCTSKTYR | |
| SCHEMBL6367145 | 0.86 | MMP2 (0.46) | ITGB3ITGAVACEMMECPA1 | |
| SCHEMBL6367149 | 0.86 | MMP2 (0.46) | ITGB3ITGAVACEMMECPA1 | |
| SCHEMBL12226091 | 0.86 | CTSL (0.52) | MMECTSLCTSBCTSSCTSK |
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 |