Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.33 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.33 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.32 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.32 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.32 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL16552322 | 0.78 | GAA (0.42) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL7779092 | 0.77 | GAA (0.40) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL9550358 | 0.75 | TP53 (0.44) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL17803033 | 0.75 | TP53 (0.44) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL21702260 | 0.75 | TP53 (0.44) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL16733096 | 0.75 | IDO1 (0.41) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL16733099 | 0.75 | IDO1 (0.41) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL31067200 | 0.75 | GAA (0.41) | GAATP53IDO1SMN1; SMN2ALDH1A1 | |
| SCHEMBL9658053 | 0.74 | ALDH1A1 (0.41) | GAATP53SMN1; SMN2ALDH1A1ADRB2 | |
| Hydrochloric Acid SCHEMBL31067225 | 0.73 | GAA (0.40) | GAATP53IDO1SMN1; SMN2ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140787-A1 | CROSSLINKERS BASED ON DIBENZALACETONE DERIVATIVES | Eastman Chemical Company (US) | 2001-10-10 | — | — | EP | claimed |
| WO-2000035854-A1 | CROSSLINKERS BASED ON DIBENZALACETONE DERIVATIVES | EASTMAN CHEMICAL COMPANY (US) | 2000-06-22 | — | — | WO | claimed |
| EP-1140787-A1 | CROSSLINKERS BASED ON DIBENZALACETONE DERIVATIVES | Eastman Chemical Company (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000035854-A1 | CROSSLINKERS BASED ON DIBENZALACETONE DERIVATIVES | EASTMAN CHEMICAL COMPANY (US) | 2000-06-22 | — | — | WO | disclosed |