Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ASPH | Q12797 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 2/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 4/20 | 0.39 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | DAO | P14920 | 1/20 | 0.39 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.38 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | RXRB | P28702 | 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 | |
|---|---|---|---|---|
| SCHEMBL3036944 | 0.97 | ASPH (0.59) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL30777934 | 0.95 | ASPH (0.57) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL22164128 | 0.95 | ASPH (0.57) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL4860299 | 0.93 | ASPH (0.55) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL15920412 | 0.87 | ASPH (0.53) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL23753333 | 0.85 | ASPH (0.49) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL31314547 | 0.85 | KDM4E (0.50) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL9156761 | 0.84 | ASPH (0.47) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL29179273 | 0.84 | ASPH (0.52) | ASPHCES2NOTUMKDM4EALDH1A1 | |
| SCHEMBL16914140 | 0.84 | ASPH (0.52) | ASPHCES2NOTUMKDM4EALDH1A1 |
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-114479099-B | Preparation method and application of 2, 5-bis (trifluoromethyl) cobalt terephthalate complex corrosion inhibitor | 贵州乌江水电开发有限责任公司思林发电厂 | 2024-02-06 | — | — | CN | disclosed |