Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SOAT1 | P35610 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | ENPP2 | Q13822 | 4/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 5/20 | 0.38 |
| ▸ | CES2 | O00748 | 3/20 | 0.37 |
| ▸ | CES1 | P23141 | 3/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL28483829 | 0.90 | SOAT1 (0.50) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Octadecanoic Acid Amide SCHEMBL8121892 | 0.89 | FAAH (0.44) | SOAT1MEN1FAAHTP53CYP1A2 | |
| SCHEMBL8660838 | 0.89 | FAAH (0.44) | SOAT1MEN1FAAHTP53CYP1A2 | |
| SCHEMBL6699378 | 0.89 | FAAH (0.44) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Octadecanoic Acid Amide SCHEMBL27564226 | 0.88 | SOAT1 (0.55) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Octadecanoic Acid Amide SCHEMBL27994152 | 0.87 | SOAT1 (0.57) | SOAT1MEN1FAAHTP53CYP1A2 | |
| SCHEMBL27595241 | 0.87 | SOAT1 (0.57) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Tetradecanamide SCHEMBL4201776 | 0.85 | SOAT1 (0.55) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Hydrochloric Acid SCHEMBL1705678 | 0.85 | SOAT1 (0.55) | SOAT1MEN1FAAHTP53CYP1A2 | |
| Octadecanoic Acid Amide SCHEMBL5346586 | 0.85 | SOAT1 (0.55) | SOAT1MEN1FAAHTP53CYP1A2 |
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-106398214-A | Preparation method of polyphenylene sulfide resin for melt-blowing | 江苏六鑫洁净新材料有限公司 | 2017-02-15 | — | — | CN | disclosed |