Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.76 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.74 |
| ▸ | ACP1 | P24666 | 1/20 | 0.66 |
| ▸ | NPC1 | O15118 | 6/20 | 0.65 |
| ▸ | RAB9A | P51151 | 6/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.65 |
| ▸ | CSNK1D | P48730 | 5/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL16445403 | 0.91 | DYRK1A (0.73) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL15281323 | 0.91 | DYRK1A (0.73) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL16445830 | 0.91 | DYRK1A (0.73) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL15271146 | 0.89 | DYRK1A (0.70) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL15271151 | 0.89 | DYRK1A (0.70) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL24317232 | 0.88 | DYRK1A (0.69) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL23104940 | 0.86 | DYRK1A (1.00) | DYRK1AACP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18154477 | 0.86 | DYRK1A (0.81) | DYRK1AACP1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL18154070 | 0.86 | DYRK1A (0.66) | DYRK1AATAD2ACP1NPC1RAB9A | |
| SCHEMBL18154110 | 0.86 | DYRK1A (0.66) | DYRK1AATAD2ACP1NPC1RAB9A |
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 3 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 |
| US-9725427-B2 | Prodrugs of riluzole and their method of use | Biohaven Pharmaceutical Holding Company Limited (US) | 2017-08-08 | — | — | US | disclosed |
| WO-2016140879-A9 | RILUZOLE PRODRUGS AND THEIR USE | BIOHAVEN PHARMACEUTICAL HOLDING COMPANY LTD. (US) | 2016-11-03 | — | — | WO | disclosed |