Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CTSS | P25774 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 6/20 | 0.35 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.34 |
| ▸ | GHSR | Q92847 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | CASP3 | P42574 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.33 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.33 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17196466 | 0.85 | LRRK2 (0.38) | CTSSCTSKLRRK2MAPK8MAPK9 | |
| SCHEMBL21089051 | 0.78 | ALDH1A1 (0.42) | LRRK2GHSRALOX5ALDH1A1NPSR1 | |
| SCHEMBL7219729 | 0.77 | L3MBTL1 (0.42) | L3MBTL1ALDH1A1SMN1; SMN2NPC1HPGD | |
| SCHEMBL17177766 | 0.73 | LRRK2 (0.40) | LRRK2 | |
| SCHEMBL18811836 | 0.71 | LRRK2 (0.35) | LRRK2MAPK8MAPK9MAPK10GPR119 | |
| SCHEMBL17173651 | 0.70 | LRRK2 (0.38) | LRRK2 | |
| SCHEMBL21089018 | 0.69 | ALOX5 (0.32) | ALOX5NPC1RAB9A | |
| SCHEMBL7219768 | 0.67 | HPGD (0.36) | CTSSCTSKL3MBTL1ALDH1A1SMN1; SMN2 | |
| SCHEMBL17196425 | 0.66 | HRH4 (0.36) | ALDH1A1NPSR1 | |
| SCHEMBL7219978 | 0.66 | HPGD (0.56) | LRRK2L3MBTL1ALDH1A1SMN1; SMN2NPC1 |
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-3495360-A1 | HETEROARYL SUBSTITUTED HETEROCYCLYL SULFONES | Grünenthal GmbH (DE) | 2019-06-12 | — | — | EP | disclosed |