Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STING1 | Q86WV6 | 1/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | CFTR | P13569 | 5/20 | 0.60 |
| ▸ | SCN4A | P35499 | 1/20 | 0.59 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.59 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.59 |
| ▸ | GOT1 | P17174 | 1/20 | 0.59 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.58 |
| ▸ | EGFR | P00533 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.52 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.52 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.52 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.52 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL29176358 | 1.00 | STING1 (0.67) | STING1MEN1KMT2ACFTRSCN4A | |
| SCHEMBL29176620 | 0.89 | NHERF1 (0.58) | STING1MEN1KMT2ACFTRSCN4A | |
| SCHEMBL29176616 | 0.89 | CFTR (0.58) | STING1MEN1KMT2ACFTRSCN4A | |
| SCHEMBL30912930 | 0.85 | P2RX1 (0.50) | STING1MEN1KMT2ACFTRSCN4A | |
| SCHEMBL29176341 | 0.85 | P2RX1 (0.50) | STING1MEN1KMT2ACFTRSCN4A | |
| SCHEMBL20567704 | 0.85 | STING1 (0.64) | STING1MEN1KMT2ACFTRGOT1 | |
| SCHEMBL4430677 | 0.84 | CFTR (0.80) | MEN1KMT2ACFTRNPC1ALDH1A1 | |
| SCHEMBL30695128 | 0.84 | NHERF1 (0.65) | MEN1KMT2ACFTRSCN4ASCN9A | |
| SCHEMBL29176615 | 0.84 | NHERF1 (0.65) | MEN1KMT2ACFTRSCN4ASCN9A | |
| SCHEMBL29176625 | 0.84 | MEN1 (0.62) | MEN1KMT2ACFTRSCN4ASCN9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024109642-A1 | USE OF BENZOAZACYCLIC COMPOUND AS ALLOSTERIC MODULATOR OF β2-ADRENOCEPTOR | 常州大学 | 2024-05-30 | — | — | WO | disclosed |