Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.60 |
| ▸ | NPC1 | O15118 | 5/20 | 0.56 |
| ▸ | RAB9A | P51151 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | CLK1 | P49759 | 1/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.51 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL30944348 | 0.89 | DYRK1A (0.68) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL28908448 | 0.89 | DYRK1A (0.68) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL30944330 | 0.89 | DYRK1A (0.68) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL28525158 | 0.89 | DYRK1A (0.68) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| Hydrochloric Acid SCHEMBL18154343 | 0.88 | DYRK1A (0.67) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL28530314 | 0.88 | DYRK1A (0.69) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL30944386 | 0.88 | DYRK1A (0.69) | DYRK1ANPC1RAB9AALDH1A1MAOA | |
| SCHEMBL18154360 | 0.83 | DYRK1A (0.69) | DYRK1ANPC1RAB9AMEN1KMT2A | |
| SCHEMBL30795396 | 0.83 | DYRK1A (0.69) | DYRK1ANPC1RAB9AMEN1KMT2A | |
| SCHEMBL18154294 | 0.82 | DYRK1A (0.64) | DYRK1ANPC1RAB9ASMN1; SMN2HDAC3 |
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-4011870-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING RILUZOLE PRODRUGS | Biohaven Pharmaceutical Holding Company Ltd. (US) | 2022-06-15 | — | — | EP | disclosed |