Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 1/20 | 0.42 |
| ▸ | TRPA1 | O75762 | 3/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 4/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8578308 | 0.94 | ABCB11 (0.46) | ABCB11TRPA1ESR1ESR2 | |
| SCHEMBL9695019 | 0.86 | KIF11 (0.41) | ESR1ESR2GRIA4 | |
| SCHEMBL3311945 | 0.85 | ESR1 (0.41) | ABCB11TRPA1ESR1ESR2 | |
| SCHEMBL9694221 | 0.85 | ABCB11 (0.47) | ABCB11TRPA1ESR1ESR2GRIA4 | |
| SCHEMBL9694205 | 0.79 | FFAR1 (0.46) | ABCB11TRPA1ESR1ESR2GRIA4 | |
| SCHEMBL2641075 | 0.78 | ABCB11 (0.52) | ABCB11TRPA1ESR1ESR2 | |
| SCHEMBL13731158 | 0.78 | ACHE (0.48) | ESR1ESR2GRIA4 | |
| SCHEMBL7409014 | 0.78 | TRPA1 (0.53) | TRPA1GRIA4PTGS2 | |
| SCHEMBL20377395 | 0.76 | ABCB11 (0.44) | ABCB11TRPA1ESR1ESR2GRIA4 | |
| SCHEMBL8580830 | 0.75 | TAAR1 (0.52) | TRPA1 |
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-5091592-A | Oxidizing 4,4*-diisopropylbiphenyl with molecular oxygen in presence of ammonia or ammonium salt, decomposing using acid catalyst | MITSUBISHI PETROCHEMICAL CO., LTD. (JP) | 1992-02-25 | — | — | US | disclosed |