Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA4 | P22748 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 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 | |
|---|---|---|---|---|
| SCHEMBL30036250 | 0.91 | CA1 (0.33) | CA1CA2CA4CA7CA9 | |
| SCHEMBL29375816 | 0.77 | CYP2D6 (0.42) | CA1CA2CA7CA9 | |
| SCHEMBL28104723 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL30670183 | 0.67 | CYP1A1 (0.43) | — | |
| SCHEMBL29499825 | 0.66 | LMNA (0.42) | CA1CA2CA4CA7CA9 | |
| SCHEMBL28710827 | 0.64 | POLB (0.35) | CA1CA2CA7CA9 | |
| SCHEMBL29397362 | 0.62 | — | — | |
| SCHEMBL1723322 | 0.60 | ACHE (0.52) | CA1CA2CA7CA9 | |
| SCHEMBL2737299 | 0.60 | CYP2D6 (0.47) | CA1CA2CA7CA9 | |
| SCHEMBL9885331 | 0.60 | CA1 (0.52) | CA1CA2CA7CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116783160-A | Libraries of compounds | 中外制药株式会社 | 2023-09-19 | — | — | CN | disclosed |