Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CA4 | P22748 | 2/20 | 0.38 |
| ▸ | THPO | P40225 | 1/20 | 0.36 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL136756 | 0.96 | — | — | |
| SCHEMBL11151294 | 0.92 | — | — | |
| Fluoride SCHEMBL28202487 | 0.92 | — | — | |
| Carbon Tetrachloride SCHEMBL4415386 | 0.82 | — | — | |
| Acetone SCHEMBL7644638 | 0.82 | — | — | |
| Acetone SCHEMBL11854533 | 0.80 | LMNA (0.46) | LMNATSHRALDH1A1TP53CA4 | |
| Trichloroacetic Acid SCHEMBL2472230 | 0.80 | TSHR (0.77) | LMNATSHRALDH1A1TP53CA4 | |
| SCHEMBL10398731 | 0.79 | ALDH1A1 (0.37) | TSHRALDH1A1TP53CA4TDP1 | |
| SCHEMBL948114 | 0.79 | ALDH1A1 (0.37) | TSHRALDH1A1TP53CA4 | |
| Trichloroethane SCHEMBL11686802 | 0.78 | — | — |
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-109516908-A | The method of purification and its application of 1,1,3- trichloroacetone | 江西天新药业有限公司 | 2019-03-26 | — | — | CN | disclosed |