Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.33 |
| ▸ | WNT3A | P56704 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 7/20 | 0.33 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.33 |
| ▸ | RPS6KA1 | Q15418 | 3/20 | 0.33 |
| ▸ | GRK2 | P25098 | 1/20 | 0.33 |
| ▸ | GRK5 | P34947 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | GCGR | P47871 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.32 |
| ▸ | SGK1 | O00141 | 2/20 | 0.32 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.32 |
| ▸ | HMGCR | P04035 | 1/20 | 0.31 |
| ▸ | MET | P08581 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL23884510 | 1.00 | MAPK1 (0.34) | MAPK1CTNNB1WNT3AROCK1RPS6KB1 | |
| SCHEMBL23905473 | 1.00 | MAPK1 (0.34) | MAPK1CTNNB1WNT3AROCK1RPS6KB1 | |
| SCHEMBL23906103 | 0.92 | DGAT1 (0.39) | MAPK1CTNNB1WNT3AROCK1RPS6KB1 | |
| SCHEMBL23905499 | 0.91 | GRIA1 (0.34) | GCGRSGK1GRIA1 | |
| SCHEMBL30251613 | 0.91 | GRIA1 (0.34) | GCGRSGK1GRIA1 | |
| SCHEMBL23884765 | 0.91 | GRIA1 (0.34) | GCGRSGK1GRIA1 | |
| SCHEMBL25474974 | 0.90 | ROCK1 (0.34) | MAPK1CTNNB1WNT3AROCK1RPS6KB1 | |
| SCHEMBL23884660 | 0.89 | MAPK1 (0.35) | MAPK1ROCK1RPS6KB1RPS6KA1GRK2 | |
| SCHEMBL23906055 | 0.89 | MAPK1 (0.35) | MAPK1ROCK1RPS6KB1RPS6KA1GRK2 | |
| SCHEMBL30252034 | 0.89 | MAPK1 (0.35) | MAPK1ROCK1RPS6KB1RPS6KA1GRK2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115715292-A | 1H-pyrazolo [4,3-g ] isoquinoline and 1H-pyrazolo [4,3-g ] quinoline derivatives as alpha-1-antitrypsin modulators for the treatment of alpha-1-antitrypsin deficiency (AATD) | 弗特克斯药品有限公司 | 2023-02-24 | — | — | CN | disclosed |