Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 3/20 | 0.67 |
| ▸ | CASP7 | P55210 | 3/20 | 0.67 |
| ▸ | CASP1 | P29466 | 2/20 | 0.67 |
| ▸ | CASP4 | P49662 | 2/20 | 0.67 |
| ▸ | CASP9 | P55211 | 2/20 | 0.67 |
| ▸ | CASP6 | P55212 | 2/20 | 0.67 |
| ▸ | CASP8 | Q14790 | 1/20 | 0.67 |
| ▸ | CA12 | O43570 | 2/20 | 0.59 |
| ▸ | CA1 | P00915 | 2/20 | 0.59 |
| ▸ | CA2 | P00918 | 2/20 | 0.59 |
| ▸ | CA9 | Q16790 | 2/20 | 0.59 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.51 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.51 |
| ▸ | ACHE | P22303 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL28799594 | 1.00 | CASP3 (0.67) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL28799595 | 0.88 | CASP1 (0.67) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL29699601 | 0.88 | CASP1 (0.67) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL28946309 | 0.86 | CASP3 (0.66) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL28468477 | 0.82 | ALDH3A1 (0.64) | CA12CA1CA2CA9HDAC1 | |
| SCHEMBL28464687 | 0.82 | ACHE (0.73) | HDAC1HDAC7ALDH1A1ACHEHDAC6 | |
| SCHEMBL8019897 | 0.82 | CASP3 (0.79) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL28469301 | 0.81 | HDAC1 (0.55) | CA12CA1CA2CA9HDAC1 | |
| SCHEMBL1217303 | 0.81 | CASP3 (0.77) | CASP3CASP7CASP1CASP4CASP9 | |
| SCHEMBL8019337 | 0.81 | CASP3 (1.00) | CASP3CASP7CASP1CASP4CASP9 |
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-111747883-B | 1-benzyl isatin derivative and synthesis method and application thereof | 中南大学 | 2022-07-01 | — | — | CN | disclosed |