Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.48 |
| ▸ | CES1 | P23141 | 4/20 | 0.48 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | PPARG | P37231 | 6/20 | 0.41 |
| ▸ | PPARD | Q03181 | 6/20 | 0.41 |
| ▸ | PPARA | Q07869 | 6/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.41 |
| ▸ | TSHR | P16473 | 4/20 | 0.41 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TLR2 | O60603 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | FABP4 | P15090 | 2/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.41 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.41 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL2573452 | 0.88 | CES2 (0.50) | CES2CES1CA2KMT2APPARG | |
| Acetic Acid SCHEMBL10615890 | 0.88 | CES2 (0.50) | CES2CES1CA2KMT2APPARG | |
| Acetic Acid SCHEMBL27659112 | 0.88 | CES2 (0.50) | CES2CES1CA2KMT2APPARG | |
| Acetic Acid SCHEMBL27734142 | 0.88 | CES2 (0.50) | CES2CES1CA2KMT2APPARG | |
| Acetic Acid SCHEMBL2572937 | 0.88 | CES2 (0.50) | CES2CES1CA2KMT2APPARG | |
| Thioglycolic Acid SCHEMBL3268156 | 0.86 | CES2 (0.44) | CES2CES1HAO1CA2KMT2A | |
| Thioglycolic Acid SCHEMBL9833354 | 0.86 | CES2 (0.44) | CES2CES1HAO1CA2KMT2A | |
| SCHEMBL3269704 | 0.83 | CA1 (0.48) | CES2CES1HAO1CA2KMT2A | |
| Octanoic Acid SCHEMBL18420626 | 0.82 | FABP3 (0.62) | CES2CES1GPR84FABP3CA1 | |
| Fumaric Acid SCHEMBL1579070 | 0.82 | CES2 (0.44) | CES2CES1CA2FABP3 |
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 |
|---|---|---|---|---|---|---|---|
| US-4269731-A | DISCOLORATION INHIBITION; MOLDING MATERIALS | ARGUS CHEMICAL CORPORATION (US) | 1981-05-26 | — | — | US | disclosed |
| EP-0024919-A2 | Process for providing monovalent and polyvalent metal, particularly antimony, mercaptocarboxylic acid ester salts; monovalent and polyvalent metal mercaptocarboxylic acid salts; polyol mercaptocarboxylic acid monoesters, and esters of such polyol mercaptocarboxylic acid esters with a mercaptocarboxylic acid; stabilizer compositions for polyvinyl chloride resins comprising such compounds; and polyvinyl chloride resin compositions comprising a stabilizing amount of such compounds | Mack, Gerry (US) | 1981-03-11 | — | — | EP | disclosed |