Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CELA1 | Q9UNI1 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 4/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA2 | P00918 | 4/20 | 0.35 |
| ▸ | CA7 | P43166 | 4/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | GFER | P55789 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.34 |
| ▸ | RELA | Q04206 | 1/20 | 0.34 |
| ▸ | FUT7 | Q11130 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27874912 | 0.79 | CYP1A2 (0.52) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL11453281 | 0.77 | CELA1 (0.46) | CELA1ALDH1A1CA12CA1CA2 | |
| Potassium SCHEMBL7063557 | 0.74 | CELA1 (0.44) | CELA1ALDH1A1CA12CA1CA2 | |
| Lithium SCHEMBL7065112 | 0.74 | CELA1 (0.44) | CELA1ALDH1A1CA12CA1CA2 | |
| SCHEMBL7063431 | 0.74 | CELA1 (0.44) | CELA1ALDH1A1CA12CA1CA2 | |
| SCHEMBL2867109 | 0.70 | CYP1A2 (0.59) | CYP1A2CA12CA1CA2CA7 | |
| SCHEMBL8596046 | 0.69 | ALDH1A1 (0.45) | CELA1ALDH1A1CA12CA1CA2 | |
| SCHEMBL15153241 | 0.69 | CA12 (0.46) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL25381186 | 0.67 | CA12 (0.48) | ALDH1A1CA12CA1CA2CA7 | |
| SCHEMBL25380099 | 0.67 | CA12 (0.48) | ALDH1A1CA12CA1CA2CA7 |
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-104016999-A | Method for preparing 3,4-alkylenedioxyfuran compound | UNIV JIANGXI NORMAL SCI & TECH | 2014-09-03 | — | — | CN | disclosed |