Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.83 |
| ▸ | TSHR | P16473 | 4/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.83 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.83 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | F2 | P00734 | 1/20 | 0.53 |
| ▸ | ELANE | P08246 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 3/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Ethaneperoxoic Acid SCHEMBL10801735 | 0.98 | TSHR (0.80) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL263307 | 0.91 | TDP1 (0.86) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL7589685 | 0.91 | TDP1 (0.86) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| Acetic Acid SCHEMBL28044564 | 0.91 | TDP1 (0.92) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| Benzene SCHEMBL9464161 | 0.91 | TSHR (1.00) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL22820 | 0.91 | TSHR (1.00) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| Hydrogen Peroxide SCHEMBL29071816 | 0.91 | TSHR (1.00) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL9183136 | 0.91 | TSHR (1.00) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| Tert-Butyl Hydroperoxide SCHEMBL22291174 | 0.89 | TDP1 (0.89) | TDP1TSHRALDH1A1HSD17B10LMNA | |
| SCHEMBL28771784 | 0.89 | TDP1 (0.96) | TDP1TSHRALDH1A1HSD17B10LMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-3472174-A1 | METHOD FOR THE PREPARATION OF SUBSTITUTED THIOLACTONES, NEW SUBSTITUTED THIOLACTONES, AND USES THEREOF | Centre National De La Recherche Scientifique (FR) | 2019-04-24 | — | — | EP | disclosed |