Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.53 |
| ▸ | AHR | P35869 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.39 |
| ▸ | WNT3A | P56704 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | RORC | P51449 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | FAAH | O00519 | 2/20 | 0.36 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.35 |
| ▸ | RAF1 | P04049 | 1/20 | 0.35 |
| ▸ | BRAF | P15056 | 1/20 | 0.35 |
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.35 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | CES1 | P23141 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28236619 | 0.81 | P2RX7 (0.59) | P2RX7AHRARKMT2AMEN1 | |
| SCHEMBL29421283 | 0.81 | P2RX7 (0.51) | P2RX7AHRARGRM5RORC | |
| SCHEMBL29421288 | 0.78 | P2RX7 (0.49) | P2RX7ARCNR2 | |
| SCHEMBL24267354 | 0.77 | P2RX7 (0.54) | P2RX7ARKMT2AMEN1GRM5 | |
| SCHEMBL28111220 | 0.72 | P2RX7 (0.49) | P2RX7AHRARKMT2AMEN1 | |
| SCHEMBL19132713 | 0.72 | RORC (0.49) | P2RX7AHRARKMT2AMEN1 | |
| SCHEMBL29421279 | 0.72 | P2RX7 (0.46) | P2RX7AHRARKMT2AMEN1 | |
| SCHEMBL29421295 | 0.71 | P2RX7 (0.48) | P2RX7AHRARKMT2AMEN1 | |
| SCHEMBL1412900 | 0.71 | P2RX7 (0.69) | P2RX7AHRKMT2AMEN1ABL1 | |
| SCHEMBL19132716 | 0.70 | RORC (0.47) | P2RX7AHRARKMT2AMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117285525-A | Novel isoxazolyl ether derivatives as GABAA alpha 5PAM | 豪夫迈·罗氏有限公司 | 2023-12-26 | — | — | CN | claimed |
| CN-109923113-B | Isoxazolyl ether derivatives as GABA A alpha 5 PAM | 豪夫迈·罗氏有限公司 | 2023-10-13 | — | — | CN | claimed |