Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 2/20 | 0.52 |
| ▸ | CA2 | P00918 | 2/20 | 0.52 |
| ▸ | CA5A | P35218 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | PRTN3 | P24158 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | GPR3 | P46089 | 1/20 | 0.36 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.36 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 1/20 | 0.36 |
| ▸ | PGK1 | P00558 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18316472 | 0.80 | CA1 (0.64) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL6184790 | 0.77 | CA1 (0.48) | CA1CA2CA5ACA9TSHR | |
| Trifluoromethylbenzene SCHEMBL4616496 | 0.77 | ALDH1A1 (0.74) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL4124865 | 0.72 | CA1 (0.67) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL28353115 | 0.72 | CYP1A2 (0.44) | CA1CA2CA5ACA9TSHR | |
| Trifluoromethylbenzene SCHEMBL65956 | 0.70 | ALDH1A1 (0.70) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL4133244 | 0.68 | CA1 (0.50) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL3957533 | 0.68 | CA1 (0.50) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL4126418 | 0.68 | CA1 (0.50) | CA1CA2CA5ACA9TSHR | |
| SCHEMBL7645200 | 0.68 | CA1 (0.50) | CA1CA2CA5ACA9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-20230275271-A1 | NONAQUEOUS ELECTROLYTIC SOLUTION AND NONAQUEOUS ELECTROLYTIC SOLUTION BATTERY | CENTRAL GLASS CO., LTD. (JP) | 2023-08-31 | — | — | US | disclosed |