Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 3/20 | 0.41 |
| ▸ | BTK | Q06187 | 3/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 8/20 | 0.34 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | HTR1D | P28221 | 2/20 | 0.34 |
| ▸ | HTR1B | P28222 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.31 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.31 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.31 |
| ▸ | CCKBR | P32239 | 1/20 | 0.31 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.31 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.31 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.31 |
| ▸ | LPL | P06858 | 1/20 | 0.30 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16110732 | 1.00 | JAK2 (0.41) | JAK2BTKTRPV1HTR1AHTR1D | |
| SCHEMBL15332752 | 0.87 | JAK2 (0.41) | JAK2BTKBRPF1GABRA1GABRG2 | |
| SCHEMBL17713762 | 0.82 | CYP11B1 (0.35) | JAK2BTKTRPV1BRD4CYP11B1 | |
| SCHEMBL24428590 | 0.81 | JAK2 (0.31) | JAK2BTKBRD4 | |
| SCHEMBL17713696 | 0.81 | JAK2 (0.35) | JAK2BTKBRD4GABRG2GABRB3 | |
| SCHEMBL17546978 | 0.79 | JAK2 (0.38) | JAK2BTK | |
| SCHEMBL19464228 | 0.78 | JAK2 (0.38) | JAK2BTKLPLLIPGP2RX7 | |
| SCHEMBL31707905 | 0.74 | ALDH1A1 (0.37) | JAK2BTKLPLLIPGP2RX7 | |
| SCHEMBL508291 | 0.74 | ALDH1A1 (0.37) | JAK2BTKLPLLIPGP2RX7 | |
| SCHEMBL1746088 | 0.73 | NOTUM (0.43) | JAK2BTK |
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-4090660-A1 | QUINOXALINE DERIVATIVES | Grünenthal GmbH (DE) | 2022-11-23 | — | — | EP | disclosed |