Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | TRIM24 | O15164 | 2/20 | 0.42 |
| ▸ | TRIM33 | Q9UPN9 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA4 | P22748 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8486388 | 0.88 | LMNA (0.47) | ALDH1A1TRIM24TRIM33LMNATSHR | |
| Ethylene SCHEMBL4704387 | 0.86 | LMNA (0.45) | ALDH1A1LMNATSHRTRPA1KMT2A | |
| SCHEMBL4359650 | 0.78 | CES2 (0.43) | ALDH1A1LMNATSHRTRPA1KMT2A | |
| SCHEMBL307206 | 0.78 | — | — | |
| Methane SCHEMBL27789915 | 0.76 | CES2 (0.41) | ALDH1A1LMNATSHRTRPA1KMT2A | |
| SCHEMBL19871212 | 0.76 | THRB (0.40) | ALDH1A1TRIM24TRIM33LMNATSHR | |
| SCHEMBL20278647 | 0.76 | THRB (0.40) | ALDH1A1TRIM24TRIM33LMNATSHR | |
| SCHEMBL14104952 | 0.76 | THRB (0.40) | ALDH1A1TRIM24TRIM33LMNATSHR | |
| SCHEMBL1437686 | 0.76 | — | — | |
| SCHEMBL14191139 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1113842-C | Methyl cyclic tetradecane-5-alkene-1-ketone | GIVAUDAN ROURE INTERNAT S A (CH) | 2003-07-09 | — | — | CN | disclosed |
| CN-1248570-A | Methyl cyclic tetradecane-5-alkene-1-ketone | GIVAUDAN ROURE INT (CH) | 2000-03-29 | — | — | CN | disclosed |