Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL23531710 | 0.86 | CA1 (0.40) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL21962740 | 0.75 | PTGS2 (0.33) | CA12CA1CA2CA9 | |
| SCHEMBL20681302 | 0.75 | ALDH1A1 (0.40) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL23569348 | 0.72 | CA2 (0.34) | CA2 | |
| SCHEMBL23569219 | 0.71 | CA2 (0.35) | CA12CA1CA2CA9 | |
| SCHEMBL23569350 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL23569845 | 0.70 | KEAP1 (0.43) | CA12CA1CA2CA9 | |
| SCHEMBL6970430 | 0.70 | CA1 (0.40) | CA1CA2NPC1L3MBTL1 | |
| SCHEMBL18610688 | 0.65 | — | — | |
| SCHEMBL13711360 | 0.64 | TYR (0.35) | NPC1L3MBTL1 |
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-2021123237-A1 | 2-AMINO-N-(AMINO-OXO-ARYL-LAMBDA6-SULFANYLIDENE)ACETAMIDE COMPOUNDS AND THEIR THERAPEUTIC USE | Oxford Drug Design Limited (GB) | 2021-06-24 | — | — | WO | disclosed |