Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 3/20 | 0.61 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
| ▸ | CASP3 | P42574 | 1/20 | 0.58 |
| ▸ | CASP4 | P49662 | 1/20 | 0.58 |
| ▸ | CASP7 | P55210 | 1/20 | 0.58 |
| ▸ | CASP9 | P55211 | 1/20 | 0.58 |
| ▸ | CASP6 | P55212 | 1/20 | 0.58 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.58 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 3/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | ALDH3A1 | P30838 | 6/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | ALDH2 | P05091 | 3/20 | 0.48 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL1217303 | 0.87 | CASP3 (0.77) | ACHECASP1CASP3CASP4CASP7 | |
| SCHEMBL16329852 | 0.83 | ACHE (0.83) | ACHEHSP90AA1TP53MAPTCA12 | |
| SCHEMBL14047967 | 0.79 | ACHE (0.75) | ACHEHSP90AA1TP53MAPTALDH3A1 | |
| SCHEMBL4597228 | 0.77 | ACHE (0.77) | ACHEHSP90AA1TP53MAPTCA12 | |
| SCHEMBL28053364 | 0.76 | ACHE (1.00) | ACHEHSP90AA1TP53MAPTALDH3A1 | |
| SCHEMBL22410741 | 0.76 | ACHE (0.75) | ACHECASP3CASP7HSP90AA1TP53 | |
| SCHEMBL8019897 | 0.75 | CASP3 (0.79) | ACHECASP1CASP3CASP4CASP7 | |
| SCHEMBL18954905 | 0.75 | CA1 (0.79) | ACHECA12CA1CA2CA9 | |
| SCHEMBL578250 | 0.75 | ACHE (0.74) | ACHECASP1CASP3CASP4CASP7 | |
| SCHEMBL13627912 | 0.75 | MAPT (0.57) | ACHECASP1CASP3CASP4CASP7 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2258365-A1 | Use of organic compounds for immunopotentiation | Novartis Vaccines and Diagnostics, Inc. (US) | 2010-12-08 | — | — | EP | disclosed |