Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 6/20 | 0.55 |
| ▸ | CES2 | O00748 | 5/20 | 0.55 |
| ▸ | TSHR | P16473 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | DAO | P14920 | 1/20 | 0.55 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 2/20 | 0.50 |
| ▸ | CA4 | P22748 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | RECQL | P46063 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Fluoride SCHEMBL27434180 | 1.00 | CES1 (0.55) | CES1CES2TSHRALDH1A1DAO | |
| SCHEMBL7378830 | 0.97 | CES1 (0.58) | CES1CES2TSHRALDH1A1DAO | |
| SCHEMBL295618 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL27436699 | 0.94 | CES1 (0.55) | CES1CES2TSHRALDH1A1DAO | |
| Hydrochloric Acid SCHEMBL27691884 | 0.94 | CES1 (0.55) | CES1CES2TSHRALDH1A1DAO | |
| Hydrochloric Acid SCHEMBL27901056 | 0.92 | CES1 (0.52) | CES1CES2TSHRALDH1A1DAO | |
| Calcium Chloride SCHEMBL27901055 | 0.89 | CES1 (0.50) | CES1CES2TSHRALDH1A1DAO | |
| Acetone SCHEMBL27854896 | 0.89 | CES1 (0.54) | CES1CES2TSHRALDH1A1DAO | |
| SCHEMBL10887198 | 0.85 | CES1 (0.54) | CES1CES2TSHRALDH1A1DAO | |
| Trifluoromethylbenzene SCHEMBL21291903 | 0.84 | ALDH1A1 (0.58) | CES1CES2TSHRALDH1A1MAPT |
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-3529232-A1 | SULPHAMIC ACID DERIVATIVES AND PRODUCTION METHODS THEREOF | Hydro-Québec (CA) | 2019-08-28 | — | — | EP | disclosed |