Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.42 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.33 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.33 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.33 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.31 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.31 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.31 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | SCN1A | P35498 | 1/20 | 0.30 |
| ▸ | SCN4A | P35499 | 1/20 | 0.30 |
| ▸ | SCN7A | Q01118 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.30 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL25571690 | 0.87 | NCF1 (0.47) | NCF1CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL24481341 | 0.86 | ACHE (0.46) | NCF1CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL24319799 | 0.83 | NCF1 (0.45) | NCF1CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL24480861 | 0.82 | NCF1 (0.45) | NCF1CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL25027121 | 0.81 | POLB (0.34) | NCF1MEN1KMT2AGNAI3GNAO1 | |
| SCHEMBL11919059 | 0.81 | NCF1 (0.46) | NCF1MEN1KMT2AGRIN2BGNAI3 | |
| SCHEMBL22703786 | 0.81 | NCF1 (0.37) | NCF1MEN1KMT2A | |
| SCHEMBL24319182 | 0.81 | NCF1 (0.46) | NCF1CACNA2D1CACNA1BCACNB1CACNA1C | |
| SCHEMBL23384365 | 0.81 | NCF1 (0.46) | NCF1MEN1KMT2AGRIN2BGNAI3 | |
| SCHEMBL22703783 | 0.80 | NCF1 (0.40) | NCF1MEN1KMT2A |
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-2023131167-A1 | COMPOUND FOR INHIBITING AND DEGRADING IRAK4, AND PHARMACEUTICAL COMPOSITION AND PHARMACEUTICAL APPLICATION THEREOF | 海思科医药集团股份有限公司 | 2023-07-13 | — | — | WO | disclosed |