Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARK7 | Q99497 | 4/20 | 1.00 |
| ▸ | CHRM5 | P08912 | 3/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.61 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.61 |
| ▸ | ALDH3A1 | P30838 | 4/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.60 |
| ▸ | MAPT | P10636 | 2/20 | 0.60 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | GSK3A | P49840 | 1/20 | 0.51 |
| ▸ | GSK3B | P49841 | 1/20 | 0.51 |
| ▸ | CMA1 | P23946 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4786048 | 0.88 | PARK7 (0.78) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4737404 | 0.86 | PARK7 (0.76) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4739092 | 0.86 | PARK7 (0.82) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL30774299 | 0.86 | PARK7 (0.82) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4738038 | 0.86 | PARK7 (0.75) | PARK7CHRM5ALDH1A1ALDH3A1TP53 | |
| SCHEMBL20874420 | 0.85 | PARK7 (0.80) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4736390 | 0.85 | PARK7 (1.00) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4736417 | 0.85 | PARK7 (0.73) | PARK7CHRM5TP53MAPTCASP3 | |
| SCHEMBL22589373 | 0.84 | PARK7 (0.78) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 | |
| SCHEMBL4738025 | 0.84 | PARK7 (0.78) | PARK7CHRM5ALDH1A1ALDH2ALDH3A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008074078-A1 | SELECTIVELY DELIVERABLE ISATIN-BASED CYTOTOXIC AGENTS | UNIVERSITY OF WOLLONGONG (AU) | 2008-06-26 | — | — | WO | disclosed |