Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1H | O95180 | 2/20 | 0.43 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.43 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 3/20 | 0.37 |
| ▸ | TACR1 | P25103 | 7/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.35 |
| ▸ | ATXN2 | Q99700 | 1/20 | 0.35 |
| ▸ | NMT1 | P30419 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL25145555 | 0.90 | CACNA1H (0.41) | CACNA1HCACNA1GGBA1HTR2CTACR1 | |
| SCHEMBL4319325 | 0.83 | CACNA1H (0.52) | CACNA1HCACNA1GGBA1HTR2CTACR1 | |
| SCHEMBL25145535 | 0.82 | GBA1 (0.41) | GBA1SLC6A4NMT1 | |
| SCHEMBL31239662 | 0.81 | ENPP2 (0.37) | CACNA1HCACNA1GTACR1ENPP2ATXN2 | |
| SCHEMBL25145972 | 0.77 | CACNA1H (0.48) | CACNA1HCACNA1GGBA1HTR2CTACR1 | |
| SCHEMBL25145533 | 0.75 | GBA1 (0.54) | GBA1SLC6A4NMT1 | |
| SCHEMBL3037834 | 0.74 | GBA1 (0.56) | GBA1SLC6A4NMT1TSHR | |
| SCHEMBL25145973 | 0.74 | CACNA1H (0.45) | CACNA1HCACNA1GGBA1HTR2CTACR1 | |
| Hydrochloric Acid SCHEMBL3034504 | 0.73 | GBA1 (0.54) | GBA1SLC6A4NMT1TSHR | |
| SCHEMBL25145957 | 0.73 | SLC6A4 (0.42) | CACNA1HCACNA1GHTR2CSLC6A4SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023144160-A1 | NEW HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-08-03 | — | — | WO | disclosed |
| WO-2023062049-A1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 2023-04-20 | — | — | WO | disclosed |