Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 15/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 9/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL24266365 | 1.00 | PTGS2 (0.44) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL25367493 | 0.84 | PTGS2 (0.42) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL24265995 | 0.83 | PTGS2 (0.40) | PTGS2PTGS1ERN1 | |
| SCHEMBL29399885 | 0.83 | PTGS2 (0.40) | PTGS2PTGS1ERN1 | |
| SCHEMBL24266361 | 0.82 | ALDH1A1 (0.46) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL29399296 | 0.80 | CA1 (0.44) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL24266208 | 0.80 | CA1 (0.44) | PTGS2PTGS1CA1CA2CA12 | |
| SCHEMBL25413527 | 0.78 | PTGS2 (0.41) | PTGS2PTGS1 | |
| SCHEMBL24265895 | 0.78 | KDM4E (0.41) | PTGS2PTGS1 | |
| SCHEMBL24265623 | 0.78 | JAK2 (0.45) | PTGS2PTGS1CA1CA2CA12 |
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-116075510-A | 1H-benzo [ d ] imidazole derivatives as TLR9 inhibitors for the treatment of fibrosis | 百时美施贵宝公司 | 2023-05-05 | — | — | CN | disclosed |