Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.81 |
| ▸ | BCHE | P06276 | 3/20 | 0.81 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.69 |
| ▸ | ALDH3A1 | P30838 | 5/20 | 0.69 |
| ▸ | ALDH2 | P05091 | 4/20 | 0.69 |
| ▸ | CDC25A | P30304 | 1/20 | 0.67 |
| ▸ | PKM | P14618 | 1/20 | 0.67 |
| ▸ | TGM2 | P21980 | 1/20 | 0.62 |
| ▸ | PARK7 | Q99497 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.56 |
| ▸ | MAOA | P21397 | 1/20 | 0.54 |
| ▸ | MAOB | P27338 | 1/20 | 0.54 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.54 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 1/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL11148969 | 0.95 | CES1 (0.78) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL11149607 | 0.93 | CES1 (0.76) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL28585885 | 0.93 | CES1 (0.76) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| Tannin Pyrogallol SCHEMBL28581735 | 0.92 | CES1 (0.69) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL10685462 | 0.89 | CES1 (1.00) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL25119569 | 0.89 | CES1 (0.85) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| Biphenyl SCHEMBL28586478 | 0.88 | CES1 (0.68) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL25119255 | 0.87 | CES1 (0.84) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL19924204 | 0.85 | CES1 (1.00) | CES1BCHEALDH1A1ALDH3A1ALDH2 | |
| SCHEMBL281618 | 0.84 | CES1 (0.76) | CES1BCHEALDH1A1ALDH3A1ALDH2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119735585-A | Novel substituted isatin-coumarin derivative and preparation method and application thereof | 广东医科大学 | 2025-04-01 | — | — | CN | disclosed |
| CN-116217547-B | Substituted isatin-8-hydroxyquinoline derivative and preparation method and application thereof | 广东医科大学 | 2024-10-22 | — | — | CN | disclosed |
| CN-118108654-A | Substituted isatin-ferulic acid ester derivative and preparation method and application thereof | 广东医科大学 | 2024-05-31 | — | — | CN | disclosed |
| CN-116217547-A | Substituted isatin-8-hydroxyquinoline derivative and preparation method and application thereof | 广东医科大学 | 2023-06-06 | — | — | CN | disclosed |
| CN-112898539-A | Long-side-chain polyaromatic hydrocarbon isatin alkaline membrane for fuel cell and preparation method thereof | 北京化工大学 | 2021-06-04 | — | — | CN | disclosed |