Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPB1 | P04792 | 1/20 | 0.50 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | APP | P05067 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8433 | 0.81 | HSPB1 (0.52) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL28135398 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| Ammonia Solution, Strong SCHEMBL27663814 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| Hydrochloric Acid SCHEMBL27912110 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL5847950 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL535259 | 0.79 | HSD17B10 (0.50) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL830158 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL28049513 | 0.79 | HSPB1 (0.50) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL13665383 | 0.79 | HSPB1 (0.55) | HSPB1CA1CA2CA9CES2 | |
| SCHEMBL132166 | 0.78 | HSPB1 (0.48) | HSPB1CA1CA2CA9CES2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110167918-A | Novel phenyl derivatives | 里维斯制药股份有限公司 | 2019-08-23 | — | — | CN | disclosed |
| CN-105384668-A | Method for preparing ether compound | SUMITOMO CHEMICAL CO | 2016-03-09 | — | — | CN | disclosed |