Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 8/20 | 0.42 |
| ▸ | CA2 | P00918 | 8/20 | 0.42 |
| ▸ | CA9 | Q16790 | 7/20 | 0.42 |
| ▸ | CA5A | P35218 | 4/20 | 0.42 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 3/20 | 0.40 |
| ▸ | CA12 | O43570 | 3/20 | 0.40 |
| ▸ | CA4 | P22748 | 2/20 | 0.40 |
| ▸ | CA7 | P43166 | 2/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.40 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | CTSB | P07858 | 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 | |
|---|---|---|---|---|
| SCHEMBL31726638 | 0.86 | CA2 (0.47) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL574790 | 0.86 | CA2 (0.47) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL4279787 | 0.84 | CA1 (0.38) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL30295970 | 0.84 | CA1 (0.38) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL30295779 | 0.83 | EDNRB (0.38) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL30296408 | 0.81 | CA2 (0.46) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL30296069 | 0.81 | CA2 (0.40) | CA1CA2CA9CA5APTGES2 | |
| SCHEMBL734879 | 0.80 | KCNN4 (0.46) | CYP2C9KCNN4PDK2 | |
| SCHEMBL30296346 | 0.78 | CARM1 (0.39) | CA1CA2CA9CA5ACA6 | |
| SCHEMBL8656962 | 0.78 | SCN9A (0.45) | CA1CA2CA9CA5ACA12 |
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-2023025277-A1 | AROMATIC RING-CONTAINING BIOLOGICAL ANTAGONIST, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 上海翰森生物医药科技有限公司 | 2023-03-02 | — | — | WO | disclosed |