Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | CTSK | P43235 | 2/20 | 0.40 |
| ▸ | CKS1B | P61024 | 1/20 | 0.40 |
| ▸ | SKP1 | P63208 | 1/20 | 0.40 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.40 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.38 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.38 |
| ▸ | JAK2 | O60674 | 2/20 | 0.38 |
| ▸ | JAK1 | P23458 | 2/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL25519242 | 0.78 | GPR119 (0.38) | CKS1BSKP1SKP2GPR119 | |
| SCHEMBL25519258 | 0.74 | GAA (0.33) | GAA | |
| SCHEMBL19220264 | 0.74 | GAA (0.33) | GAA | |
| SCHEMBL20998179 | 0.72 | CHRM1 (0.38) | — | |
| SCHEMBL25275768 | 0.71 | GPR119 (0.40) | GPR119MAP4K4 | |
| SCHEMBL31696458 | 0.71 | GAA (0.39) | GAANFKB1NFKB2RELAEPHX2 | |
| SCHEMBL19927685 | 0.71 | GPR119 (0.43) | GPR119 | |
| SCHEMBL4099515 | 0.71 | GAA (0.49) | GAANFKB1NFKB2RELACTSK | |
| SCHEMBL17527846 | 0.71 | GAA (0.49) | GAANFKB1NFKB2RELACTSK | |
| SCHEMBL21887787 | 0.71 | GAA (0.49) | GAANFKB1NFKB2RELACTSK |
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-118027038-A | Hydrogen-bond-assisted chiral dicycloimidazole organic micromolecular catalyst and synthesis method thereof | 上海交通大学 | 2024-05-14 | — | — | CN | disclosed |