Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TYK2 | P29597 | 1/20 | 0.50 |
| ▸ | RIOK2 | Q9BVS4 | 4/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | GSK3B | P49841 | 5/20 | 0.44 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.43 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.42 |
| ▸ | GSK3A | P49840 | 2/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.41 |
| ▸ | BRAF | P15056 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL15358570 | 1.00 | TYK2 (0.50) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| Hydrochloric Acid SCHEMBL15350070 | 0.98 | TYK2 (0.49) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| SCHEMBL15627415 | 0.87 | TYK2 (0.52) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| SCHEMBL27342084 | 0.86 | TYK2 (0.51) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| SCHEMBL22809608 | 0.86 | TYK2 (0.51) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| SCHEMBL15358566 | 0.86 | AAK1 (0.49) | TYK2 | |
| SCHEMBL21078952 | 0.86 | AAK1 (0.49) | TYK2 | |
| Hydrochloric Acid SCHEMBL15350524 | 0.84 | AAK1 (0.48) | TYK2 | |
| SCHEMBL25997633 | 0.82 | TYK2 (0.48) | TYK2RIOK2MAPTGSK3BACVRL1 | |
| SCHEMBL15358582 | 0.82 | LMNA (0.45) | MAPTGSK3BPOLBNR3C2BRAF |
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-2841421-B1 | AMIDE DERIVATIVES AS TTX-S BLOCKERS | RAQUALIA PHARMA INC (JP) | 2019-06-05 | — | — | EP | disclosed |