Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS1 | P23219 | 4/20 | 0.54 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.54 |
| ▸ | LTA4H | P09960 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.46 |
| ▸ | TSPO | P30536 | 4/20 | 0.44 |
| ▸ | ALB | P02768 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL29011979 | 0.84 | L3MBTL1 (0.51) | PTGS1PTGS2CA12CA1CA2 | |
| SCHEMBL3819637 | 0.82 | CA12 (0.58) | CA12CA1CA2CA9CA14 | |
| SCHEMBL17077468 | 0.80 | LMNA (0.49) | — | |
| SCHEMBL11738087 | 0.80 | LTA4H (0.63) | LTA4HGLAL3MBTL1 | |
| SCHEMBL9488090 | 0.77 | PTGS1 (0.51) | PTGS1PTGS2TSPOALBOPRK1 | |
| SCHEMBL9339338 | 0.75 | PTGS1 (0.58) | PTGS1PTGS2LTA4HTSPOOPRK1 | |
| SCHEMBL21105143 | 0.75 | PTGS1 (0.50) | PTGS1PTGS2LTA4HTSPOOPRK1 | |
| SCHEMBL1078323 | 0.73 | LTA4H (0.50) | LTA4HGLAL3MBTL1 | |
| SCHEMBL17101823 | 0.73 | GRM5 (0.43) | — | |
| SCHEMBL2506700 | 0.73 | CYP1A2 (0.52) | PTGS1PTGS2TSPOL3MBTL1 |
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-111527078-B | Pyridinecarbonyl derivatives and their therapeutic use as TRPC6 inhibitors | 勃林格殷格翰国际公司 | 2023-06-02 | — | — | CN | disclosed |