Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.60 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PRKCA | P17252 | 3/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.31 |
| ▸ | TLR4 | O00206 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.31 |
| ▸ | PAOX | Q6QHF9 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL4278956 | 0.93 | CYP1A2 (0.66) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL11854942 | 0.90 | CYP1A2 (0.49) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL11877463 | 0.90 | CYP1A2 (0.49) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL3621337 | 0.89 | CYP1A2 (0.54) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL3280050 | 0.84 | CYP1A2 (0.57) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL8176138 | 0.84 | CYP1A2 (0.57) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL6856383 | 0.82 | CYP1A2 (0.55) | CYP1A2PPARGCA1CA9PRKCA | |
| SCHEMBL3621368 | 0.79 | CYP1A2 (0.44) | CYP1A2PPARGCA1CA9PRKCA | |
| Acetic Acid SCHEMBL8471925 | 0.79 | CYP1A2 (0.84) | CYP1A2PPARGPRKCAALDH1A1 | |
| SCHEMBL864461 | 0.78 | CYP1A2 (0.62) | CYP1A2PPARGCA1CA9PRKCA |
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-1991016317-A1 | PROCESS FOR PREPARING FURANE COMPOSITIONS | HENKEL CORPORATION (US) | 1991-10-31 | — | — | WO | disclosed |