Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 8/20 | 0.55 |
| ▸ | TNK2 | Q07912 | 2/20 | 0.40 |
| ▸ | GRM1 | Q13255 | 5/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.37 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 1/20 | 0.37 |
| ▸ | JAK1 | P23458 | 1/20 | 0.37 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ATR | Q13535 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL22476344 | 1.00 | GRM5 (0.55) | GRM5TNK2GRM1ESR2PDK4 | |
| SCHEMBL22476353 | 0.86 | GRM5 (0.53) | GRM5TNK2GRM1ESR2PDK4 | |
| SCHEMBL29110609 | 0.83 | GRM5 (0.37) | GRM5 | |
| SCHEMBL19971864 | 0.83 | GRM5 (0.46) | GRM5TNK2GRM1ESR2NR1H2 | |
| SCHEMBL941018 | 0.76 | GRM5 (0.61) | GRM5GRM1ESR2PDK4 | |
| SCHEMBL2893138 | 0.76 | GRM5 (0.63) | GRM5GRM1ESR2PDK4NR1H2 | |
| SCHEMBL3348910 | 0.75 | GRM5 (0.66) | GRM5GRM1ESR2PDK4JAK1 | |
| SCHEMBL19989696 | 0.74 | GRM5 (0.69) | GRM5GRM1ESR2PDK4GPR119 | |
| SCHEMBL14995149 | 0.73 | GRM5 (0.70) | GRM5GRM1ESR2PDK4GPR119 | |
| SCHEMBL20001581 | 0.73 | GRM5 (0.60) | GRM5GRM1ESR2PDK4NR1H2 |
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-116854709-A | Reversible inhibitors of Bruton's tyrosine kinase and application thereof | 药雅科技(上海)有限公司 | 2023-10-10 | — | — | CN | disclosed |