Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 13/20 | 0.48 |
| ▸ | CA1 | P00915 | 13/20 | 0.48 |
| ▸ | CA2 | P00918 | 13/20 | 0.48 |
| ▸ | CA4 | P22748 | 13/20 | 0.48 |
| ▸ | CA6 | P23280 | 13/20 | 0.48 |
| ▸ | CA7 | P43166 | 13/20 | 0.48 |
| ▸ | CA9 | Q16790 | 13/20 | 0.48 |
| ▸ | CA13 | Q8N1Q1 | 13/20 | 0.48 |
| ▸ | CA14 | Q9ULX7 | 13/20 | 0.48 |
| ▸ | CA5B | Q9Y2D0 | 13/20 | 0.48 |
| ▸ | CA3 | P07451 | 7/20 | 0.46 |
| ▸ | CA5A | P35218 | 10/20 | 0.44 |
| ▸ | CISD1 | Q9NZ45 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL11078370 | 0.85 | CA1 (0.44) | CA12CA1CA2CA4CA6 | |
| SCHEMBL11083041 | 0.82 | CA2 (0.44) | CA1CA2CA4 | |
| SCHEMBL11074780 | 0.77 | — | — | |
| SCHEMBL11086834 | 0.76 | NPSR1 (0.36) | — | |
| SCHEMBL11080625 | 0.75 | TSHR (0.42) | — | |
| SCHEMBL11074848 | 0.75 | NPSR1 (0.38) | CA12CA1CA2CA4CA7 | |
| SCHEMBL11081217 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL7280219 | 0.72 | SLC6A9 (0.44) | — | |
| SCHEMBL11083144 | 0.72 | SLC6A9 (0.35) | — | |
| SCHEMBL11085913 | 0.71 | SLC6A9 (0.36) | — |
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-4440941-A | Aroyl-aminoacids, amides and esters thereof | USV PHARMACEUTICAL CORPORATION (US) | 1984-04-03 | — | — | US | disclosed |