Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.49 |
| ▸ | NR1H2 | P55055 | 8/20 | 0.48 |
| ▸ | NR1H3 | Q13133 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.43 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.43 |
| ▸ | KIF11 | P52732 | 1/20 | 0.42 |
| ▸ | RXRA | P19793 | 1/20 | 0.42 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6243674 | 0.86 | KCNH2 (0.50) | KCNH2NR1H2NR1H3PTGS2LOXL2 | |
| SCHEMBL29321413 | 0.85 | ALDH1A1 (0.48) | KCNH2NR1H2NR1H3CA12CA2 | |
| SCHEMBL2140712 | 0.84 | PTGS2 (0.53) | KCNH2NR1H2NR1H3ALDH1A1PTGS2 | |
| SCHEMBL15758712 | 0.82 | CYP19A1 (0.60) | CA12CA2CA9ALDH1A1 | |
| SCHEMBL14320650 | 0.81 | CA12 (0.51) | KCNH2NR1H2NR1H3CA12CA2 | |
| SCHEMBL5831675 | 0.81 | PTGS2 (0.56) | NR1H2NR1H3PTGS2 | |
| SCHEMBL17153735 | 0.81 | PTGS2 (0.50) | KCNH2NR1H2NR1H3CA12CA2 | |
| SCHEMBL5893176 | 0.81 | NR1H2 (0.51) | KCNH2NR1H2NR1H3LOXL2 | |
| SCHEMBL5908704 | 0.80 | CA2 (0.61) | CA12CA2CA9PTGS2KIF11 | |
| SCHEMBL21770154 | 0.79 | CA12 (0.53) | KCNH2NR1H2NR1H3CA12CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0794942-A1 | SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1997-09-17 | — | — | EP | disclosed |
| WO-1996016934-A1 | SUBSTITUTED BIPHENYL COMPOUNDS FOR THE TREATMENT OF INFLAMMATION | G.D. SEARLE & CO. (US) | 1996-06-06 | — | — | WO | disclosed |