Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LPL | P06858 | 6/20 | 0.40 |
| ▸ | LIPG | Q9Y5X9 | 6/20 | 0.40 |
| ▸ | CYP2E1 | P05181 | 4/20 | 0.40 |
| ▸ | CYP2C8 | P10632 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 4/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.40 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | F11 | P03951 | 1/20 | 0.36 |
| ▸ | AOC1 | P19801 | 4/20 | 0.35 |
| ▸ | AOC3 | Q16853 | 4/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
| ▸ | CCNC | P24863 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20517178 | 1.00 | LPL (0.40) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL24456240 | 0.87 | LPL (0.37) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL18356347 | 0.85 | F11 (0.38) | LPLLIPGUCHL1F11AOC1 | |
| SCHEMBL23295525 | 0.83 | CYP11B1 (0.38) | LPLLIPGUCHL1F11 | |
| SCHEMBL29542703 | 0.83 | CYP11B1 (0.38) | LPLLIPGUCHL1F11 | |
| SCHEMBL2352761 | 0.77 | LPL (0.34) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL29515710 | 0.77 | LPL (0.34) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL29572040 | 0.77 | HTT (0.37) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL4119052 | 0.77 | HTT (0.37) | LPLLIPGCYP2E1CYP2C8CYP2D6 | |
| SCHEMBL166233 | 0.76 | GAA (0.34) | LPLLIPGUCHL1F11 |
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-110678466-B | Diazanaphthalenes as HPK1 inhibitors | 豪夫迈·罗氏有限公司 | 2023-01-31 | — | — | CN | disclosed |